(1S,6R)-6-[(4-ethyl-5-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[(4-ethyl-5-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[(4-ethyl-3-isopropoxycarbonyl-5-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[[[4-ethyl-5-methyl-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(4-ethyl-5-methyl-3-propan-2-yloxycarbonylthiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[(4-ethyl-3-isopropoxycarbonyl-5-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2CC=CCC2C(=O)O)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC(C)C)NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)C

InChI

InChI=1S/C19H25NO5S/c1-5-12-11(4)26-17(15(12)19(24)25-10(2)3)20-16(21)13-8-6-7-9-14(13)18(22)23/h6-7,10,13-14H,5,8-9H2,1-4H3,(H,20,21)(H,22,23)/t13-,14+/m1/s1