[3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: [3-(dicyanomethylene)-2-oxo-indolin-1-yl]methyl 1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: 1-(benzenesulfonyl)-2-piperidinecarboxylic acid [3-(dicyanomethylidene)-2-oxo-1-indolyl]methyl ester IUPAC Name: [3-(dicyanomethylidene)-2-oxoindol-1-yl]methyl 1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: 1-besylpipecolinic acid [3-(dicyanomethylene)-2-keto-indolin-1-yl]methyl ester Formula: C24H20N4O5S MolecularWeight: 476.5044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCN2C3=CC=CC=C3C(=C(C#N)C#N)C2=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)OCN2C3=CC=CC=C3C(=C(C#N)C#N)C2=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H20N4O5S/c25-14-17(15-26)22-19-10-4-5-11-20(19)27(23(22)29)16-33-24(30)21-12-6-7-13-28(21)34(31,32)18-8-2-1-3-9-18/h1-5,8-11,21H,6-7,12-13,16H2