3-[[1-[(2-chlorophenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[[1-[(2-chlorophenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-phenyl-propanoic acid Openeye Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridyl]carbamoylamino]-3-phenyl-propanoic acid CAS Name: 3-[[[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxopyridin-3-yl]carbamoylamino]-3-phenylpropanoic acid Traditional Name: 3-[[1-(2-chlorobenzyl)-2-hydroxy-4-keto-3-pyridyl]carbamoylamino]-3-phenyl-propionic acid Formula: C22H20ClN3O5 MolecularWeight: 441.8643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)NC2=C(N(C=CC2=O)CC3=CC=CC=C3Cl)O

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)NC2=C(N(C=CC2=O)CC3=CC=CC=C3Cl)O

InChI

InChI=1S/C22H20ClN3O5/c23-16-9-5-4-8-15(16)13-26-11-10-18(27)20(21(26)30)25-22(31)24-17(12-19(28)29)14-6-2-1-3-7-14/h1-11,17,30H,12-13H2,(H,28,29)(H2,24,25,31)