1-[(5-bromanylthiophen-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[(5-bromo-2-thienyl)methyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[(5-bromo-2-thiophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[(5-bromothiophen-2-yl)methyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-[(5-bromo-2-thienyl)methyl]-6-keto-nicotinic acid Formula: C11H8BrNO3S MolecularWeight: 314.15512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)N(C=C1C(=O)O)CC2=CC=C(S2)Br

Isomeric SMILES

C1=CC(=O)N(C=C1C(=O)O)CC2=CC=C(S2)Br

InChI

InChI=1S/C11H8BrNO3S/c12-9-3-2-8(17-9)6-13-5-7(11(15)16)1-4-10(13)14/h1-5H,6H2,(H,15,16)