methyl 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexyl-propanoate

Systemtic Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexyl-propanoate Openeye Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexyl-propanoate CAS Name: 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexylpropanoic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexylpropanoate Traditional Name: 2-[(3-cyanophenyl)sulfonylamino]-3-cyclohexyl-propionic acid methyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCC1)NS(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

COC(=O)C(CC1CCCCC1)NS(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H22N2O4S/c1-23-17(20)16(11-13-6-3-2-4-7-13)19-24(21,22)15-9-5-8-14(10-15)12-18/h5,8-10,13,16,19H,2-4,6-7,11H2,1H3