(1S,6S)-6-[(3-ethoxycarbonyl-5-methyl-thiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[(3-ethoxycarbonyl-5-methyl-thiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[(3-ethoxycarbonyl-5-methyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[(3-ethoxycarbonyl-5-methyl-2-thiophenyl)amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[(3-ethoxycarbonyl-5-methylthiophen-2-yl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[(3-carbethoxy-5-methyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H22NO5S- MolecularWeight: 364.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2CC(=C(CC2C(=O)[O-])C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C)NC(=O)[C@H]2CC(=C(C[C@@H]2C(=O)[O-])C)C

InChI

InChI=1S/C18H23NO5S/c1-5-24-18(23)14-8-11(4)25-16(14)19-15(20)12-6-9(2)10(3)7-13(12)17(21)22/h8,12-13H,5-7H2,1-4H3,(H,19,20)(H,21,22)/p-1/t12-,13-/m0/s1