1-[(3-methylphenyl)methylcarbamoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(3-methylphenyl)methylcarbamoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-(m-tolylmethylcarbamoylamino)cyclohexanecarboxylic acid CAS Name: 1-[[[(3-methylphenyl)methylamino]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)methylcarbamoylamino]cyclohexane-1-carboxylic acid Traditional Name: 1-[(3-methylbenzyl)carbamoylamino]cyclohexanecarboxylic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)NC2(CCCCC2)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)NC2(CCCCC2)C(=O)O

InChI

InChI=1S/C16H22N2O3/c1-12-6-5-7-13(10-12)11-17-15(21)18-16(14(19)20)8-3-2-4-9-16/h5-7,10H,2-4,8-9,11H2,1H3,(H,19,20)(H2,17,18,21)