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

Systemtic Name: 3-[[1-[(2-bromophenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]propanoic acid Openeye Name: 3-[[1-[(2-bromophenyl)methyl]-2-hydroxy-4-oxo-3-pyridyl]carbamoylamino]propanoic acid CAS Name: 3-[[[[1-[(2-bromophenyl)methyl]-2-hydroxy-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-[(2-bromophenyl)methyl]-2-hydroxy-4-oxopyridin-3-yl]carbamoylamino]propanoic acid Traditional Name: 3-[[1-(2-bromobenzyl)-2-hydroxy-4-keto-3-pyridyl]carbamoylamino]propionic acid Formula: C16H16BrN3O5 MolecularWeight: 410.21934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O)Br

InChI

InChI=1S/C16H16BrN3O5/c17-11-4-2-1-3-10(11)9-20-8-6-12(21)14(15(20)24)19-16(25)18-7-5-13(22)23/h1-4,6,8,24H,5,7,9H2,(H,22,23)(H2,18,19,25)