4-[(3-chlorophenyl)amino]-2-[(2-methoxyphenyl)methyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-chlorophenyl)amino]-2-[(2-methoxyphenyl)methyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-chloroanilino)-2-[(2-methoxyphenyl)methyl]-4-oxo-butanoic acid CAS Name: 4-(3-chloroanilino)-2-[(2-methoxyphenyl)methyl]-4-oxobutanoic acid IUPAC Name: 4-(3-chloroanilino)-2-[(2-methoxyphenyl)methyl]-4-oxobutanoic acid Traditional Name: 4-(3-chloroanilino)-4-keto-2-o-anisyl-butyric acid Formula: C18H18ClNO4 MolecularWeight: 347.79282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC(CC(=O)NC2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1CC(CC(=O)NC2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C18H18ClNO4/c1-24-16-8-3-2-5-12(16)9-13(18(22)23)10-17(21)20-15-7-4-6-14(19)11-15/h2-8,11,13H,9-10H2,1H3,(H,20,21)(H,22,23)