(1S,2R)-2-[[(4-methoxyphenyl)carbonylamino]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-[[(4-methoxyphenyl)carbonylamino]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[[(4-methoxybenzoyl)amino]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[[(4-methoxybenzoyl)amino]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[(p-anisoylamino)carbamoyl]cyclohexanecarboxylic acid Formula: C16H20N2O5 MolecularWeight: 320.3404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)O

InChI

InChI=1S/C16H20N2O5/c1-23-11-8-6-10(7-9-11)14(19)17-18-15(20)12-4-2-3-5-13(12)16(21)22/h6-9,12-13H,2-5H2,1H3,(H,17,19)(H,18,20)(H,21,22)/t12-,13+/m1/s1