2-[(4-ethylphenyl)methyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide

Systemtic Name: 2-[(4-ethylphenyl)methyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide Openeye Name: 2-[(4-ethylphenyl)methyl]-3-oxo-N-(3-pyridylmethyl)isoindoline-1-carboxamide CAS Name: 2-[(4-ethylphenyl)methyl]-3-oxo-N-(3-pyridinylmethyl)-1H-isoindole-1-carboxamide IUPAC Name: 2-[(4-ethylphenyl)methyl]-3-oxo-N-(pyridin-3-ylmethyl)-1H-isoindole-1-carboxamide Traditional Name: 2-(4-ethylbenzyl)-3-keto-N-(3-pyridylmethyl)isoindoline-1-carboxamide Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(C3=CC=CC=C3C2=O)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H23N3O2/c1-2-17-9-11-18(12-10-17)16-27-22(20-7-3-4-8-21(20)24(27)29)23(28)26-15-19-6-5-13-25-14-19/h3-14,22H,2,15-16H2,1H3,(H,26,28)