2-[[4-(2,4-dichlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[4-(2,4-dichlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[4-(2,4-dichlorophenyl)-3-ethoxycarbonyl-2-thienyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[[4-(2,4-dichlorophenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[4-(2,4-dichlorophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[3-carbethoxy-4-(2,4-dichlorophenyl)-2-thienyl]carbamoyl]cyclohexanecarboxylic acid Formula: C21H21Cl2NO5S MolecularWeight: 470.36614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)Cl)Cl)NC(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)Cl)Cl)NC(=O)C3CCCCC3C(=O)O

InChI

InChI=1S/C21H21Cl2NO5S/c1-2-29-21(28)17-15(12-8-7-11(22)9-16(12)23)10-30-19(17)24-18(25)13-5-3-4-6-14(13)20(26)27/h7-10,13-14H,2-6H2,1H3,(H,24,25)(H,26,27)