L6C
phenyl N-[(1R)-3-oxidanylidene-1-phenyl-propyl]carbamate
Created: | 2013-02-11 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 35 |
Chiral Atom Count | 1 |
Bond Count | 36 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | phenyl N-[(1R)-3-oxidanylidene-1-phenyl-propyl]carbamate |
Systematic Name (OpenEye OEToolkits) | phenyl N-[(1R)-3-oxidanylidene-1-phenyl-propyl]carbamate |
Formula | C16 H15 N O3 |
Molecular Weight | 269.295 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Oc1ccccc1)NC(c2ccccc2)CC=O |
SMILES | CACTVS | 3.385 | O=CC[CH](NC(=O)Oc1ccccc1)c2ccccc2 |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C(CC=O)NC(=O)Oc2ccccc2 |
Canonical SMILES | CACTVS | 3.385 | O=CC[C@@H](NC(=O)Oc1ccccc1)c2ccccc2 |
Canonical SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)[C@@H](CC=O)NC(=O)Oc2ccccc2 |
InChI | InChI | 1.03 | InChI=1S/C16H15NO3/c18-12-11-15(13-7-3-1-4-8-13)17-16(19)20-14-9-5-2-6-10-14/h1-10,12,15H,11H2,(H,17,19)/t15-/m1/s1 |
InChIKey | InChI | 1.03 | HHWCOMIRIZKFCW-OAHLLOKOSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 78225384 |