N-(2,3-dimethylcyclohexa-1,3-dien-1-yl)-1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoindole-5-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexa-1,3-dien-1-yl)-1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoindole-5-carboxamide Openeye Name: N-(2,3-dimethylcyclohexa-1,3-dien-1-yl)-1,3-dioxo-2-(2-pyridyl)isoindoline-5-carboxamide CAS Name: N-(2,3-dimethyl-1-cyclohexa-1,3-dienyl)-1,3-dioxo-2-(2-pyridinyl)-5-isoindolecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexa-1,3-dien-1-yl)-1,3-dioxo-2-pyridin-2-ylisoindole-5-carboxamide Traditional Name: N-(2,3-dimethylcyclohexa-1,3-dien-1-yl)-1,3-diketo-2-(2-pyridyl)isoindoline-5-carboxamide Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(=C1C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=N4

Isomeric SMILES

CC1=CCCC(=C1C)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=N4

InChI

InChI=1S/C22H19N3O3/c1-13-6-5-7-18(14(13)2)24-20(26)15-9-10-16-17(12-15)22(28)25(21(16)27)19-8-3-4-11-23-19/h3-4,6,8-12H,5,7H2,1-2H3,(H,24,26)