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

Systemtic Name: [3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-[4-(methoxycarbonylamino)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: [3-(dicyanomethylene)-2-oxo-indolin-1-yl]methyl 1-[4-(methoxycarbonylamino)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(methoxycarbonylamino)phenyl]sulfonyl-4-piperidinecarboxylic acid [3-(dicyanomethylidene)-2-oxo-1-indolyl]methyl ester IUPAC Name: [3-(dicyanomethylidene)-2-oxoindol-1-yl]methyl 1-[4-(methoxycarbonylamino)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-(carbomethoxyamino)phenyl]sulfonylisonipecotic acid [3-(dicyanomethylene)-2-keto-indolin-1-yl]methyl ester Formula: C26H23N5O7S MolecularWeight: 549.55512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCN3C4=CC=CC=C4C(=C(C#N)C#N)C3=O

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCN3C4=CC=CC=C4C(=C(C#N)C#N)C3=O

InChI

InChI=1S/C26H23N5O7S/c1-37-26(34)29-19-6-8-20(9-7-19)39(35,36)30-12-10-17(11-13-30)25(33)38-16-31-22-5-3-2-4-21(22)23(24(31)32)18(14-27)15-28/h2-9,17H,10-13,16H2,1H3,(H,29,34)