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

Systemtic Name: 3-[[1-[(2-chlorophenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridyl]carbamoylamino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[1-[(2-chlorophenyl)methyl]-2-hydroxy-4-oxopyridin-3-yl]carbamoylamino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[1-(2-chlorobenzyl)-2-hydroxy-4-keto-3-pyridyl]carbamoylamino]-3-(3-pyridyl)propionic acid Formula: C21H19ClN4O5 MolecularWeight: 442.85236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=O)C(=C2O)NC(=O)NC(CC(=O)O)C3=CN=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=O)C(=C2O)NC(=O)NC(CC(=O)O)C3=CN=CC=C3)Cl

InChI

InChI=1S/C21H19ClN4O5/c22-15-6-2-1-4-14(15)12-26-9-7-17(27)19(20(26)30)25-21(31)24-16(10-18(28)29)13-5-3-8-23-11-13/h1-9,11,16,30H,10,12H2,(H,28,29)(H2,24,25,31)