2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-quinolin-3-yl-propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-quinolin-3-yl-propanamide Openeye Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(3-quinolyl)propanamide CAS Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(3-quinolinyl)propanamide IUPAC Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-quinolin-3-ylpropanamide Traditional Name: 2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(3-quinolyl)propionamide Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)N3C(=O)C4CC=CCC4C3=O

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2N=C1)N3C(=O)C4CC=CCC4C3=O

InChI

InChI=1S/C20H19N3O3/c1-12(23-19(25)15-7-3-4-8-16(15)20(23)26)18(24)22-14-10-13-6-2-5-9-17(13)21-11-14/h2-6,9-12,15-16H,7-8H2,1H3,(H,22,24)