ethyl (1S,6R)-6-methyl-2-oxidanylidene-4-[(4-sulfamoylphenyl)amino]cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6R)-6-methyl-2-oxidanylidene-4-[(4-sulfamoylphenyl)amino]cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-6-methyl-2-oxo-4-(4-sulfamoylanilino)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-methyl-2-oxo-4-(4-sulfamoylanilino)-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-6-methyl-2-oxo-4-(4-sulfamoylanilino)cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-2-keto-6-methyl-4-(4-sulfamoylanilino)cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)NC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CC(=CC1=O)NC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C16H20N2O5S/c1-3-23-16(20)15-10(2)8-12(9-14(15)19)18-11-4-6-13(7-5-11)24(17,21)22/h4-7,9-10,15,18H,3,8H2,1-2H3,(H2,17,21,22)/t10-,15+/m1/s1