1-[2-[(3-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(3-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(3-methoxycarbonyl-2-methyl-anilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-(3-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(3-methoxycarbonyl-2-methylanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(3-carbomethoxy-2-methyl-anilino)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C18H23NO5 MolecularWeight: 333.37892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CC2(CCCCC2)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CC2(CCCCC2)C(=O)O)C(=O)OC

InChI

InChI=1S/C18H23NO5/c1-12-13(16(21)24-2)7-6-8-14(12)19-15(20)11-18(17(22)23)9-4-3-5-10-18/h6-8H,3-5,9-11H2,1-2H3,(H,19,20)(H,22,23)