2-(2-methylquinolin-4-yl)-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-isoindol-1-one

Systemtic Name: 2-(2-methylquinolin-4-yl)-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-isoindol-1-one Openeye Name: 2-(2-methyl-4-quinolyl)-3-[2-oxo-2-(1-piperidyl)ethyl]isoindolin-1-one CAS Name: 2-(2-methyl-4-quinolinyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-3H-isoindol-1-one IUPAC Name: 2-(2-methylquinolin-4-yl)-3-(2-oxo-2-piperidin-1-ylethyl)-3H-isoindol-1-one Traditional Name: 3-(2-keto-2-piperidino-ethyl)-2-(2-methyl-4-quinolyl)isoindolin-1-one Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)N3C(C4=CC=CC=C4C3=O)CC(=O)N5CCCCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)N3C(C4=CC=CC=C4C3=O)CC(=O)N5CCCCC5

InChI

InChI=1S/C25H25N3O2/c1-17-15-22(20-11-5-6-12-21(20)26-17)28-23(16-24(29)27-13-7-2-8-14-27)18-9-3-4-10-19(18)25(28)30/h3-6,9-12,15,23H,2,7-8,13-14,16H2,1H3