1-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-(4-methylphenyl)imino-indol-2-one

Systemtic Name: 1-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-(4-methylphenyl)imino-indol-2-one Openeye Name: 1-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-(p-tolylimino)indolin-2-one CAS Name: 1-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-3-(4-methylphenyl)imino-2-indolone IUPAC Name: 1-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-3-(4-methylphenyl)iminoindol-2-one Traditional Name: 1-[(4-piperonylpiperazino)methyl]-3-(p-tolylimino)oxindole Formula: C28H28N4O3 MolecularWeight: 468.54692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H28N4O3/c1-20-6-9-22(10-7-20)29-27-23-4-2-3-5-24(23)32(28(27)33)18-31-14-12-30(13-15-31)17-21-8-11-25-26(16-21)35-19-34-25/h2-11,16H,12-15,17-19H2,1H3