[3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-(4-nitrophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: [3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-(4-nitrophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: [3-(dicyanomethylene)-2-oxo-indolin-1-yl]methyl 1-(4-nitrophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-nitrophenyl)sulfonyl-3-piperidinecarboxylic acid [3-(dicyanomethylidene)-2-oxo-1-indolyl]methyl ester IUPAC Name: [3-(dicyanomethylidene)-2-oxoindol-1-yl]methyl 1-(4-nitrophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-nosylnipecotic acid [3-(dicyanomethylene)-2-keto-indolin-1-yl]methyl ester Formula: C24H19N5O7S MolecularWeight: 521.50196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCN3C4=CC=CC=C4C(=C(C#N)C#N)C3=O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCN3C4=CC=CC=C4C(=C(C#N)C#N)C3=O

InChI

InChI=1S/C24H19N5O7S/c25-12-17(13-26)22-20-5-1-2-6-21(20)28(23(22)30)15-36-24(31)16-4-3-11-27(14-16)37(34,35)19-9-7-18(8-10-19)29(32)33/h1-2,5-10,16H,3-4,11,14-15H2