3-ethylsulfanyl-2-phenyl-quinoline-4,8-dicarboxylic acid

Systemtic Name: 3-ethylsulfanyl-2-phenyl-quinoline-4,8-dicarboxylic acid Openeye Name: 3-ethylsulfanyl-2-phenyl-quinoline-4,8-dicarboxylic acid CAS Name: 3-(ethylthio)-2-phenylquinoline-4,8-dicarboxylic acid IUPAC Name: 3-ethylsulfanyl-2-phenylquinoline-4,8-dicarboxylic acid Traditional Name: 3-(ethylthio)-2-phenyl-quinoline-4,8-dicarboxylic acid Formula: C19H15NO4S MolecularWeight: 353.3917

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N=C2C(=C1C(=O)O)C=CC=C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCSC1=C(N=C2C(=C1C(=O)O)C=CC=C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H15NO4S/c1-2-25-17-14(19(23)24)12-9-6-10-13(18(21)22)16(12)20-15(17)11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,21,22)(H,23,24)