methyl (1R,6S)-1-benzamido-3,4-dimethyl-6-thiophen-2-yl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,6S)-1-benzamido-3,4-dimethyl-6-thiophen-2-yl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,6S)-1-benzamido-3,4-dimethyl-6-(2-thienyl)cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-1-benzamido-3,4-dimethyl-6-thiophen-2-yl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,6S)-1-benzamido-3,4-dimethyl-6-thiophen-2-ylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-1-benzamido-3,4-dimethyl-6-(2-thienyl)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C21H23NO3S MolecularWeight: 369.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C2=CC=CS2)(C(=O)OC)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C[C@@]([C@H](C1)C2=CC=CS2)(C(=O)OC)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23NO3S/c1-14-12-17(18-10-7-11-26-18)21(13-15(14)2,20(24)25-3)22-19(23)16-8-5-4-6-9-16/h4-11,17H,12-13H2,1-3H3,(H,22,23)/t17-,21-/m1/s1