1-[2-[[3,5-bis(ethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[[3,5-bis(ethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-[[3,5-bis(ethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-[[3,5-bis(ethoxycarbonyl)-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-[[3,5-bis(ethoxycarbonyl)-4-methylthiophen-2-yl]amino]-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-[(3,5-dicarbethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C20H27NO7S MolecularWeight: 425.49588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CC2(CCCCC2)C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CC2(CCCCC2)C(=O)O

InChI

InChI=1S/C20H27NO7S/c1-4-27-17(23)14-12(3)15(18(24)28-5-2)29-16(14)21-13(22)11-20(19(25)26)9-7-6-8-10-20/h4-11H2,1-3H3,(H,21,22)(H,25,26)