(1R,2S)-2-methyl-1-[(phenylmethyl)carbamoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-methyl-1-[(phenylmethyl)carbamoylamino]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-1-(benzylcarbamoylamino)-2-methyl-cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-methyl-1-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-1-(benzylcarbamoylamino)-2-methylcyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-1-(benzylcarbamoylamino)-2-methyl-cyclohexanecarboxylic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1(C(=O)O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CCCC[C@@]1(C(=O)O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O3/c1-12-7-5-6-10-16(12,14(19)20)18-15(21)17-11-13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3,(H,19,20)(H2,17,18,21)/t12-,16+/m0/s1