methyl 5-bromanyl-1-[2-(4-hydroxyphenyl)ethyl]-6-oxidanylidene-pyridine-3-carboxylate hydrochloride

Systemtic Name: methyl 5-bromanyl-1-[2-(4-hydroxyphenyl)ethyl]-6-oxidanylidene-pyridine-3-carboxylate hydrochloride Openeye Name: methyl 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxo-pyridine-3-carboxylate hydrochloride CAS Name: 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxopyridine-3-carboxylate hydrochloride Traditional Name: 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-keto-nicotinic acid methyl ester hydrochloride Formula: C15H15BrClNO4 MolecularWeight: 388.6409

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)Br)CCC2=CC=C(C=C2)O.Cl

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)Br)CCC2=CC=C(C=C2)O.Cl

InChI

InChI=1S/C15H14BrNO4.ClH/c1-21-15(20)11-8-13(16)14(19)17(9-11)7-6-10-2-4-12(18)5-3-10;/h2-5,8-9,18H,6-7H2,1H3;1H