2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(2-naphthyl)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(2-naphthalen-2-yl-2-oxoethyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-(2-naphthyl)ethyl]thio]nicotinic acid Formula: C18H13NO3S MolecularWeight: 323.36572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C18H13NO3S/c20-16(11-23-17-15(18(21)22)6-3-9-19-17)14-8-7-12-4-1-2-5-13(12)10-14/h1-10H,11H2,(H,21,22)