N-(2-ethyl-6-methyl-phenyl)-3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-oxidanylidene-2-(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-oxo-2-(3-pyridylmethyl)isoindoline-4-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-oxo-2-(3-pyridinylmethyl)-1H-isoindole-4-carboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-oxo-2-(pyridin-3-ylmethyl)-1H-isoindole-4-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-keto-2-(3-pyridylmethyl)isoindoline-4-carboxamide Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=C3C(=CC=C2)CN(C3=O)CC4=CN=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=C3C(=CC=C2)CN(C3=O)CC4=CN=CC=C4)C

InChI

InChI=1S/C24H23N3O2/c1-3-18-9-4-7-16(2)22(18)26-23(28)20-11-5-10-19-15-27(24(29)21(19)20)14-17-8-6-12-25-13-17/h4-13H,3,14-15H2,1-2H3,(H,26,28)