(1R,2S,3S)-1,2-dimethyl-3-(phenylcarbamoyl)cyclohexane-1-carboxylate

Systemtic Name: (1R,2S,3S)-1,2-dimethyl-3-(phenylcarbamoyl)cyclohexane-1-carboxylate Openeye Name: (1R,2S,3S)-1,2-dimethyl-3-(phenylcarbamoyl)cyclohexanecarboxylate CAS Name: (1R,2S,3S)-3-[anilino(oxo)methyl]-1,2-dimethyl-1-cyclohexanecarboxylate IUPAC Name: (1R,2S,3S)-1,2-dimethyl-3-(phenylcarbamoyl)cyclohexane-1-carboxylate Traditional Name: (1R,2S,3S)-1,2-dimethyl-3-(phenylcarbamoyl)cyclohexanecarboxylate Formula: C16H20NO3- MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCCC1(C)C(=O)[O-])C(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@H]1[C@H](CCC[C@@]1(C)C(=O)[O-])C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H21NO3/c1-11-13(9-6-10-16(11,2)15(19)20)14(18)17-12-7-4-3-5-8-12/h3-5,7-8,11,13H,6,9-10H2,1-2H3,(H,17,18)(H,19,20)/p-1/t11-,13-,16+/m0/s1