methyl (3S)-3-acetyloxy-4-[(2-aminocarbonylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl (3S)-3-acetyloxy-4-[(2-aminocarbonylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl (3S)-3-acetoxy-4-(2-carbamoylanilino)-4-oxo-butanoate CAS Name: (3S)-3-acetyloxy-4-(2-carbamoylanilino)-4-oxobutanoic acid methyl ester IUPAC Name: methyl (3S)-3-acetyloxy-4-(2-carbamoylanilino)-4-oxobutanoate Traditional Name: (3S)-3-acetoxy-4-(2-carbamoylanilino)-4-keto-butyric acid methyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(=O)OC)C(=O)NC1=CC=CC=C1C(=O)N

Isomeric SMILES

CC(=O)O[C@@H](CC(=O)OC)C(=O)NC1=CC=CC=C1C(=O)N

InChI

InChI=1S/C14H16N2O6/c1-8(17)22-11(7-12(18)21-2)14(20)16-10-6-4-3-5-9(10)13(15)19/h3-6,11H,7H2,1-2H3,(H2,15,19)(H,16,20)/t11-/m0/s1