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

Systemtic Name: 1-[(5-ethylthiophen-2-yl)methyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)methyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)methyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)methyl]-6-keto-nicotinic acid Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CN2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)CN2C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C13H13NO3S/c1-2-10-4-5-11(18-10)8-14-7-9(13(16)17)3-6-12(14)15/h3-7H,2,8H2,1H3,(H,16,17)