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

Systemtic Name: 2-[4-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]pentan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-(4-benzylpiperazine-1-carbonyl)-3-methyl-butyl]isoindolin-1-one CAS Name: 2-[4-methyl-1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]pentan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzylpiperazin-1-yl)-4-methyl-1-oxopentan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[1-(4-benzylpiperazine-1-carbonyl)-3-methyl-butyl]isoindolin-1-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H31N3O2/c1-19(2)16-23(28-18-21-10-6-7-11-22(21)24(28)29)25(30)27-14-12-26(13-15-27)17-20-8-4-3-5-9-20/h3-11,19,23H,12-18H2,1-2H3