(3Z)-1-(4-methylphenyl)sulfonyl-4,6-dinitro-3-(phenylmethylidene)-2H-indole

Systemtic Name: (3Z)-1-(4-methylphenyl)sulfonyl-4,6-dinitro-3-(phenylmethylidene)-2H-indole Openeye Name: (3Z)-3-benzylidene-4,6-dinitro-1-(p-tolylsulfonyl)indoline CAS Name: (3Z)-1-(4-methylphenyl)sulfonyl-4,6-dinitro-3-(phenylmethylene)-2H-indole IUPAC Name: (3Z)-3-benzylidene-1-(4-methylphenyl)sulfonyl-4,6-dinitro-2H-indole Traditional Name: (3Z)-3-benzal-4,6-dinitro-1-tosyl-indoline Formula: C22H17N3O6S MolecularWeight: 451.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=CC3=CC=CC=C3)C4=C(C=C(C=C42)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C/C(=C\C3=CC=CC=C3)/C4=C(C=C(C=C42)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O6S/c1-15-7-9-19(10-8-15)32(30,31)23-14-17(11-16-5-3-2-4-6-16)22-20(23)12-18(24(26)27)13-21(22)25(28)29/h2-13H,14H2,1H3/b17-11+