4-azanyl-2-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(3-chloro-4-methylphenyl)carbamoylamino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-keto-butyric acid Formula: C12H14ClN3O4 MolecularWeight: 299.71026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC(CC(=O)N)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC(CC(=O)N)C(=O)O)Cl

InChI

InChI=1S/C12H14ClN3O4/c1-6-2-3-7(4-8(6)13)15-12(20)16-9(11(18)19)5-10(14)17/h2-4,9H,5H2,1H3,(H2,14,17)(H,18,19)(H2,15,16,20)