[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 3-[methoxy(methyl)sulfamoyl]benzoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 3-[methoxy(methyl)sulfamoyl]benzoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 3-[methoxy(methyl)sulfamoyl]benzoate CAS Name: 3-[methoxy(methyl)sulfamoyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 3-[methoxy(methyl)sulfamoyl]benzoate Traditional Name: 3-[methoxy(methyl)sulfamoyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CN(OC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CN(OC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OCC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C17H21N3O6S/c1-20(25-2)27(23,24)14-7-5-6-13(10-14)16(22)26-11-15(21)19-17(12-18)8-3-4-9-17/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,19,21)