1-[2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(o-tolyl)-1,3-dioxo-isoindoline-5-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-(2-methylphenyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-methylphenyl)-1,3-dioxoisoindole-5-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[1,3-diketo-2-(o-tolyl)isoindoline-5-carbonyl]isonipecotamide Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C22H21N3O4/c1-13-4-2-3-5-18(13)25-21(28)16-7-6-15(12-17(16)22(25)29)20(27)24-10-8-14(9-11-24)19(23)26/h2-7,12,14H,8-11H2,1H3,(H2,23,26)