3-azanyl-4-[(1-chloranyl-3-methoxy-3-oxidanylidene-1-phenyl-propan-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[(1-chloranyl-3-methoxy-3-oxidanylidene-1-phenyl-propan-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[chloro(phenyl)methyl]-2-methoxy-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[(1-chloro-3-methoxy-3-oxo-1-phenylpropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[(1-chloro-3-methoxy-3-oxo-1-phenylpropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[(1-carbomethoxy-2-chloro-2-phenyl-ethyl)amino]-4-keto-butyric acid Formula: C14H17ClN2O5 MolecularWeight: 328.74818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN2O5/c1-22-14(21)12(11(15)8-5-3-2-4-6-8)17-13(20)9(16)7-10(18)19/h2-6,9,11-12H,7,16H2,1H3,(H,17,20)(H,18,19)