3-(4-methylphenyl)imino-1-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]indol-2-one

Systemtic Name: 3-(4-methylphenyl)imino-1-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]indol-2-one Openeye Name: 1-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-3-(p-tolylimino)indolin-2-one CAS Name: 3-(4-methylphenyl)imino-1-[[4-(3-phenylprop-2-enyl)-1-piperazine-1,4-diiumyl]methyl]-2-indolone IUPAC Name: 3-(4-methylphenyl)imino-1-[[4-(3-phenylprop-2-enyl)piperazine-1,4-diium-1-yl]methyl]indol-2-one Traditional Name: 1-[(4-cinnamylpiperazine-1,4-diium-1-yl)methyl]-3-(p-tolylimino)oxindole Formula: C29H32N4O+2 MolecularWeight: 452.59058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CC[NH+](CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CC[NH+](CC4)CC=CC5=CC=CC=C5

InChI

InChI=1S/C29H30N4O/c1-23-13-15-25(16-14-23)30-28-26-11-5-6-12-27(26)33(29(28)34)22-32-20-18-31(19-21-32)17-7-10-24-8-3-2-4-9-24/h2-16H,17-22H2,1H3/p+2