8-(7-methoxy-3-phenyl-quinolin-2-yl)sulfanyloctanoic acid

Systemtic Name: 8-(7-methoxy-3-phenyl-quinolin-2-yl)sulfanyloctanoic acid Openeye Name: 8-[(7-methoxy-3-phenyl-2-quinolyl)sulfanyl]octanoic acid CAS Name: 8-[(7-methoxy-3-phenyl-2-quinolinyl)thio]octanoic acid IUPAC Name: 8-(7-methoxy-3-phenylquinolin-2-yl)sulfanyloctanoic acid Traditional Name: 8-[(7-methoxy-3-phenyl-2-quinolyl)thio]caprylic acid Formula: C24H27NO3S MolecularWeight: 409.54108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C3=CC=CC=C3)SCCCCCCCC(=O)O

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)C3=CC=CC=C3)SCCCCCCCC(=O)O

InChI

InChI=1S/C24H27NO3S/c1-28-20-14-13-19-16-21(18-10-6-5-7-11-18)24(25-22(19)17-20)29-15-9-4-2-3-8-12-23(26)27/h5-7,10-11,13-14,16-17H,2-4,8-9,12,15H2,1H3,(H,26,27)