1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-(4-propan-2-ylphenyl)imino-indol-2-one

Systemtic Name: 1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-(4-propan-2-ylphenyl)imino-indol-2-one Openeye Name: 3-(4-isopropylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]indolin-2-one CAS Name: 1-[[4-(4-nitrophenyl)-1-piperazin-1-iumyl]methyl]-3-(4-propan-2-ylphenyl)imino-2-indolone IUPAC Name: 1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-(4-propan-2-ylphenyl)iminoindol-2-one Traditional Name: 1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-p-cumenylimino-oxindole Formula: C28H30N5O3+ MolecularWeight: 484.5695

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N5O3/c1-20(2)21-7-9-22(10-8-21)29-27-25-5-3-4-6-26(25)32(28(27)34)19-30-15-17-31(18-16-30)23-11-13-24(14-12-23)33(35)36/h3-14,20H,15-19H2,1-2H3/p+1