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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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