3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indol-2-one

Systemtic Name: 3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indol-2-one Openeye Name: 3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indolin-2-one CAS Name: 3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-2-indolone IUPAC Name: 3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indol-2-one Traditional Name: 3-(3,4-dimethylphenyl)imino-1-[[4-(4-nitrophenyl)piperazino]methyl]oxindole Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-])C

InChI

InChI=1S/C27H27N5O3/c1-19-7-8-21(17-20(19)2)28-26-24-5-3-4-6-25(24)31(27(26)33)18-29-13-15-30(16-14-29)22-9-11-23(12-10-22)32(34)35/h3-12,17H,13-16,18H2,1-2H3