(2R)-4-[(3-chlorophenyl)amino]-4-oxidanylidene-2-[[(2R)-2-oxidanylpropyl]amino]butanoic acid

Systemtic Name: (2R)-4-[(3-chlorophenyl)amino]-4-oxidanylidene-2-[[(2R)-2-oxidanylpropyl]amino]butanoic acid Openeye Name: (2R)-4-(3-chloroanilino)-2-[[(2R)-2-hydroxypropyl]amino]-4-oxo-butanoic acid CAS Name: (2R)-4-(3-chloroanilino)-2-[[(2R)-2-hydroxypropyl]amino]-4-oxobutanoic acid IUPAC Name: (2R)-4-(3-chloroanilino)-2-[[(2R)-2-hydroxypropyl]amino]-4-oxobutanoic acid Traditional Name: (2R)-4-(3-chloroanilino)-2-[[(2R)-2-hydroxypropyl]amino]-4-keto-butyric acid Formula: C13H17ClN2O4 MolecularWeight: 300.73808

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(CC(=O)NC1=CC(=CC=C1)Cl)C(=O)O)O

Isomeric SMILES

C[C@H](CN[C@H](CC(=O)NC1=CC(=CC=C1)Cl)C(=O)O)O

InChI

InChI=1S/C13H17ClN2O4/c1-8(17)7-15-11(13(19)20)6-12(18)16-10-4-2-3-9(14)5-10/h2-5,8,11,15,17H,6-7H2,1H3,(H,16,18)(H,19,20)/t8-,11-/m1/s1