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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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