(1S,6R)-3,4-dimethyl-6-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-3,4-dimethyl-6-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-3,4-dimethyl-6-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-3,4-dimethyl-6-[oxo-[2-(4-sulfamoylphenyl)ethylamino]methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-3,4-dimethyl-6-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-3,4-dimethyl-6-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylate Formula: C18H23N2O5S- MolecularWeight: 379.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@@H]([C@@H](C1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)[O-])C

InChI

InChI=1S/C18H24N2O5S/c1-11-9-15(16(18(22)23)10-12(11)2)17(21)20-8-7-13-3-5-14(6-4-13)26(19,24)25/h3-6,15-16H,7-10H2,1-2H3,(H,20,21)(H,22,23)(H2,19,24,25)/p-1/t15-,16+/m1/s1