N-[2-(cyclohexen-1-yl)ethyl]-1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoindole-5-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoindole-5-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-1,3-dioxo-2-(2-pyridyl)isoindoline-5-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-1,3-dioxo-2-(2-pyridinyl)-5-isoindolecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-1,3-dioxo-2-pyridin-2-ylisoindole-5-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-1,3-diketo-2-(2-pyridyl)isoindoline-5-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=N4

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=N4

InChI

InChI=1S/C22H21N3O3/c26-20(24-13-11-15-6-2-1-3-7-15)16-9-10-17-18(14-16)22(28)25(21(17)27)19-8-4-5-12-23-19/h4-6,8-10,12,14H,1-3,7,11,13H2,(H,24,26)