2-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-methyl-butyl]isoindolin-1-one CAS Name: 2-[1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-methyl-1-oxopentan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-methyl-1-oxopentan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[1-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-methyl-butyl]isoindolin-1-one Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(CC(C)C)N3CC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C(CC(C)C)N3CC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C26H33N3O2/c1-18(2)16-24(29-17-21-9-5-6-10-22(21)25(29)30)26(31)28-14-12-27(13-15-28)23-11-7-8-19(3)20(23)4/h5-11,18,24H,12-17H2,1-4H3