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

Systemtic Name: (1S,6R)-6-[(2-methoxycarbonylthiophen-3-yl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[(2-methoxycarbonyl-3-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[[(2-methoxycarbonyl-3-thiophenyl)amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(2-methoxycarbonylthiophen-3-yl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[(2-carbomethoxy-3-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=C(SC=C2)C(=O)OC)C(=O)O)C

Isomeric SMILES

CC1=C(C[C@@H]([C@@H](C1)C(=O)NC2=C(SC=C2)C(=O)OC)C(=O)O)C

InChI

InChI=1S/C16H19NO5S/c1-8-6-10(11(15(19)20)7-9(8)2)14(18)17-12-4-5-23-13(12)16(21)22-3/h4-5,10-11H,6-7H2,1-3H3,(H,17,18)(H,19,20)/t10-,11+/m1/s1