(1R,6S)-6-[(3-methoxycarbonylthiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[(3-methoxycarbonylthiophen-2-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[(3-methoxycarbonyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[(3-methoxycarbonyl-2-thiophenyl)amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(3-methoxycarbonylthiophen-2-yl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[(3-carbomethoxy-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C16H18NO5S- MolecularWeight: 336.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=C(C=CS2)C(=O)OC)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NC2=C(C=CS2)C(=O)OC)C(=O)[O-])C

InChI

InChI=1S/C16H19NO5S/c1-8-6-11(12(15(19)20)7-9(8)2)13(18)17-14-10(4-5-23-14)16(21)22-3/h4-5,11-12H,6-7H2,1-3H3,(H,17,18)(H,19,20)/p-1/t11-,12+/m0/s1