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

Systemtic Name: (1S,6S)-6-[(3-methoxycarbonyl-5-propyl-thiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[(3-methoxycarbonyl-5-propyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[(3-methoxycarbonyl-5-propyl-2-thiophenyl)amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[(3-methoxycarbonyl-5-propylthiophen-2-yl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[(3-carbomethoxy-5-propyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C19H24NO5S- MolecularWeight: 378.46256

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C2CC(=C(CC2C(=O)[O-])C)C)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)[C@H]2CC(=C(C[C@@H]2C(=O)[O-])C)C)C(=O)OC

InChI

InChI=1S/C19H25NO5S/c1-5-6-12-9-15(19(24)25-4)17(26-12)20-16(21)13-7-10(2)11(3)8-14(13)18(22)23/h9,13-14H,5-8H2,1-4H3,(H,20,21)(H,22,23)/p-1/t13-,14-/m0/s1