(1R,2S)-2-[[(3-methylphenyl)carbonylamino]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[[(3-methylphenyl)carbonylamino]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[[(3-methylbenzoyl)amino]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[[(3-methylphenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[[(3-methylbenzoyl)amino]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(m-toluoylamino)carbamoyl]cyclohexanecarboxylate Formula: C16H19N2O4- MolecularWeight: 303.33306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NNC(=O)C2CCCCC2C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NNC(=O)[C@H]2CCCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C16H20N2O4/c1-10-5-4-6-11(9-10)14(19)17-18-15(20)12-7-2-3-8-13(12)16(21)22/h4-6,9,12-13H,2-3,7-8H2,1H3,(H,17,19)(H,18,20)(H,21,22)/p-1/t12-,13+/m0/s1