1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-(2-quinolin-8-ylethyl)isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-(phenylmethyl)-N-(2-quinolin-8-ylethyl)isoindole-5-carboxamide Openeye Name: 2-benzyl-1,3-dioxo-N-[2-(8-quinolyl)ethyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(phenylmethyl)-N-[2-(8-quinolinyl)ethyl]-5-isoindolecarboxamide IUPAC Name: 2-benzyl-1,3-dioxo-N-(2-quinolin-8-ylethyl)isoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-[2-(8-quinolyl)ethyl]isoindoline-5-carboxamide Formula: C27H21N3O3 MolecularWeight: 435.47394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C27H21N3O3/c31-25(29-15-13-20-9-4-8-19-10-5-14-28-24(19)20)21-11-12-22-23(16-21)27(33)30(26(22)32)17-18-6-2-1-3-7-18/h1-12,14,16H,13,15,17H2,(H,29,31)