6-[[4-(3,4-dichlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[4-(3,4-dichlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[4-(3,4-dichlorophenyl)-3-ethoxycarbonyl-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[[4-(3,4-dichlorophenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[4-(3,4-dichlorophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[3-carbethoxy-4-(3,4-dichlorophenyl)-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C23H23Cl2NO5S MolecularWeight: 496.40342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)Cl)Cl)NC(=O)C3CC(=C(CC3C(=O)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)Cl)Cl)NC(=O)C3CC(=C(CC3C(=O)O)C)C

InChI

InChI=1S/C23H23Cl2NO5S/c1-4-31-23(30)19-16(13-5-6-17(24)18(25)9-13)10-32-21(19)26-20(27)14-7-11(2)12(3)8-15(14)22(28)29/h5-6,9-10,14-15H,4,7-8H2,1-3H3,(H,26,27)(H,28,29)