4-[(2,5-dimethylphenyl)amino]-3-(3-methoxyphenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2,5-dimethylphenyl)amino]-3-(3-methoxyphenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,5-dimethylanilino)-3-(3-methoxyphenyl)-4-oxo-butanoic acid CAS Name: 4-(2,5-dimethylanilino)-3-(3-methoxyphenyl)-4-oxobutanoic acid IUPAC Name: 4-(2,5-dimethylanilino)-3-(3-methoxyphenyl)-4-oxobutanoic acid Traditional Name: 4-(2,5-dimethylanilino)-4-keto-3-(3-methoxyphenyl)butyric acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-12-7-8-13(2)17(9-12)20-19(23)16(11-18(21)22)14-5-4-6-15(10-14)24-3/h4-10,16H,11H2,1-3H3,(H,20,23)(H,21,22)