6-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(3-ethoxycarbonyl-5-ethyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[(3-ethoxycarbonyl-5-ethyl-2-thiophenyl)amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(3-ethoxycarbonyl-5-ethylthiophen-2-yl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(3-carbethoxy-5-ethyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2CC(=C(CC2C(=O)O)C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2CC(=C(CC2C(=O)O)C)C)C(=O)OCC

InChI

InChI=1S/C19H25NO5S/c1-5-12-9-15(19(24)25-6-2)17(26-12)20-16(21)13-7-10(3)11(4)8-14(13)18(22)23/h9,13-14H,5-8H2,1-4H3,(H,20,21)(H,22,23)