phenethyl (1S,2R)-2-thiophen-2-ylcarbonylcyclohexane-1-carboxylate

Systemtic Name: phenethyl (1S,2R)-2-thiophen-2-ylcarbonylcyclohexane-1-carboxylate Openeye Name: phenethyl (1S,2R)-2-(thiophene-2-carbonyl)cyclohexanecarboxylate CAS Name: (1S,2R)-2-[oxo(thiophen-2-yl)methyl]-1-cyclohexanecarboxylic acid phenethyl ester IUPAC Name: phenethyl (1S,2R)-2-(thiophene-2-carbonyl)cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-(2-thenoyl)cyclohexanecarboxylic acid phenethyl ester Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)C2=CC=CS2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)C2=CC=CS2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C20H22O3S/c21-19(18-11-6-14-24-18)16-9-4-5-10-17(16)20(22)23-13-12-15-7-2-1-3-8-15/h1-3,6-8,11,14,16-17H,4-5,9-10,12-13H2/t16-,17+/m1/s1