YLE

8-(furan-3-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one

Created:	2023-12-05
Last modified:	2024-10-02

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1 entries where YLE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	15

2D diagram of YLE

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Chemical Component Summary
Name	8-(furan-3-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Systematic Name (OpenEye OEToolkits)	8-(furan-3-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Formula	C₁₅ H₁₂ N₂ O₂
Molecular Weight	252.268
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=C1NCCc2c1[nH]c3c2cccc3c4cocc4
SMILES	OpenEye OEToolkits	2.0.7	c1cc2c3c([nH]c2c(c1)c4ccoc4)C(=O)NCC3
Canonical SMILES	CACTVS	3.385	O=C1NCCc2c1[nH]c3c2cccc3c4cocc4
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc2c3c([nH]c2c(c1)c4ccoc4)C(=O)NCC3
InChI	InChI	1.06	InChI=1S/C15H12N2O2/c18-15-14-12(4-6-16-15)11-3-1-2-10(13(11)17-14)9-5-7-19-8-9/h1-3,5,7-8,17H,4,6H2,(H,16,18)
InChIKey	InChI	1.06	RVVFCLYULJUEDG-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	172011820

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