[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] 2-acetamido-2-phenyl-ethanoate

Systemtic Name: [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] 2-acetamido-2-phenyl-ethanoate Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] 2-acetamido-2-phenyl-acetate CAS Name: 2-acetamido-2-phenylacetic acid [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] 2-acetamido-2-phenylacetate Traditional Name: 2-acetamido-2-phenyl-acetic acid [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H29NO3 MolecularWeight: 331.44916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(C2=CC=CC=C2)NC(=O)C)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)OC(=O)C(C2=CC=CC=C2)NC(=O)C)C(C)C

InChI

InChI=1S/C20H29NO3/c1-13(2)17-11-10-14(3)12-18(17)24-20(23)19(21-15(4)22)16-8-6-5-7-9-16/h5-9,13-14,17-19H,10-12H2,1-4H3,(H,21,22)/t14-,17+,18-,19?/m0/s1