6-[[(3-methoxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[(3-methoxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[(3-methoxybenzoyl)amino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[[(3-methoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[(3-methoxybenzoyl)amino]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(m-anisoylamino)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C18H22N2O5 MolecularWeight: 346.37768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NNC(=O)C2=CC(=CC=C2)OC)C(=O)O)C

Isomeric SMILES

CC1=C(CC(C(C1)C(=O)NNC(=O)C2=CC(=CC=C2)OC)C(=O)O)C

InChI

InChI=1S/C18H22N2O5/c1-10-7-14(15(18(23)24)8-11(10)2)17(22)20-19-16(21)12-5-4-6-13(9-12)25-3/h4-6,9,14-15H,7-8H2,1-3H3,(H,19,21)(H,20,22)(H,23,24)