2-(4-ethoxyphenyl)sulfanylquinoline-4-carboxylic acid

Systemtic Name: 2-(4-ethoxyphenyl)sulfanylquinoline-4-carboxylic acid Openeye Name: 2-(4-ethoxyphenyl)sulfanylquinoline-4-carboxylic acid CAS Name: 2-[(4-ethoxyphenyl)thio]-4-quinolinecarboxylic acid IUPAC Name: 2-(4-ethoxyphenyl)sulfanylquinoline-4-carboxylic acid Traditional Name: 2-(p-phenetylthio)cinchoninic acid Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C18H15NO3S/c1-2-22-12-7-9-13(10-8-12)23-17-11-15(18(20)21)14-5-3-4-6-16(14)19-17/h3-11H,2H2,1H3,(H,20,21)