4-azanyl-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-4-keto-butyric acid Formula: C13H15ClN2O5 MolecularWeight: 314.7216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2O5/c1-7-4-8(14)2-3-10(7)21-6-12(18)16-9(13(19)20)5-11(15)17/h2-4,9H,5-6H2,1H3,(H2,15,17)(H,16,18)(H,19,20)