4-[(3-methylphenyl)amino]-4-oxidanylidene-2-(3-oxidanylpropylamino)butanoic acid

Systemtic Name: 4-[(3-methylphenyl)amino]-4-oxidanylidene-2-(3-oxidanylpropylamino)butanoic acid Openeye Name: 2-(3-hydroxypropylamino)-4-(3-methylanilino)-4-oxo-butanoic acid CAS Name: 2-(3-hydroxypropylamino)-4-(3-methylanilino)-4-oxobutanoic acid IUPAC Name: 2-(3-hydroxypropylamino)-4-(3-methylanilino)-4-oxobutanoic acid Traditional Name: 2-(3-hydroxypropylamino)-4-keto-4-(m-toluidino)butyric acid Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCCO

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCCO

InChI

InChI=1S/C14H20N2O4/c1-10-4-2-5-11(8-10)16-13(18)9-12(14(19)20)15-6-3-7-17/h2,4-5,8,12,15,17H,3,6-7,9H2,1H3,(H,16,18)(H,19,20)