(3R)-4-[(2,5-dimethylphenyl)amino]-3-[(3-methoxyphenyl)methyl]-4-oxidanylidene-butanoate

Systemtic Name: (3R)-4-[(2,5-dimethylphenyl)amino]-3-[(3-methoxyphenyl)methyl]-4-oxidanylidene-butanoate Openeye Name: (3R)-4-(2,5-dimethylanilino)-3-[(3-methoxyphenyl)methyl]-4-oxo-butanoate CAS Name: (3R)-4-(2,5-dimethylanilino)-3-[(3-methoxyphenyl)methyl]-4-oxobutanoate IUPAC Name: (3R)-4-(2,5-dimethylanilino)-3-[(3-methoxyphenyl)methyl]-4-oxobutanoate Traditional Name: (3R)-4-(2,5-dimethylanilino)-4-keto-3-m-anisyl-butyrate Formula: C20H22NO4- MolecularWeight: 340.39298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(CC2=CC(=CC=C2)OC)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](CC2=CC(=CC=C2)OC)CC(=O)[O-]

InChI

InChI=1S/C20H23NO4/c1-13-7-8-14(2)18(9-13)21-20(24)16(12-19(22)23)10-15-5-4-6-17(11-15)25-3/h4-9,11,16H,10,12H2,1-3H3,(H,21,24)(H,22,23)/p-1/t16-/m1/s1