2-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-5-methyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-5-methyl-2-thienyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[[3-ethoxycarbonyl-4-(4-fluorophenyl)-5-methyl-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-5-methylthiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[3-carbethoxy-4-(4-fluorophenyl)-5-methyl-2-thienyl]carbamoyl]cyclohexanecarboxylic acid Formula: C22H24FNO5S MolecularWeight: 433.493063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24FNO5S/c1-3-29-22(28)18-17(13-8-10-14(23)11-9-13)12(2)30-20(18)24-19(25)15-6-4-5-7-16(15)21(26)27/h8-11,15-16H,3-7H2,1-2H3,(H,24,25)(H,26,27)