4-[[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 4-[[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanyl-ethyl]amino]-2-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 4-[[2-(3-bromo-4-methoxy-phenyl)-2-hydroxy-ethyl]amino]-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 4-[[2-(3-bromo-4-methoxyphenyl)-2-hydroxyethyl]amino]-2-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 4-[[2-(3-bromo-4-methoxyphenyl)-2-hydroxyethyl]amino]-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 4-[[2-(3-bromo-4-methoxy-phenyl)-2-hydroxy-ethyl]amino]-2-keto-1H-pyridine-3-carboxylic acid Formula: C15H15BrN2O5 MolecularWeight: 383.194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC2=C(C(=O)NC=C2)C(=O)O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC2=C(C(=O)NC=C2)C(=O)O)O)Br

InChI

InChI=1S/C15H15BrN2O5/c1-23-12-3-2-8(6-9(12)16)11(19)7-18-10-4-5-17-14(20)13(10)15(21)22/h2-6,11,19H,7H2,1H3,(H,21,22)(H2,17,18,20)