2-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenyl-butyl]sulfanylethanoic acid

Systemtic Name: 2-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenyl-butyl]sulfanylethanoic acid Openeye Name: 2-[1-[4-[(6-methoxy-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]sulfanylacetic acid CAS Name: 2-[[1-[4-[(6-methoxy-2-quinolinyl)methoxy]phenyl]-4-phenylbutyl]thio]acetic acid IUPAC Name: 2-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenylbutyl]sulfanylacetic acid Traditional Name: 2-[[1-[4-[(6-methoxy-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]thio]acetic acid Formula: C29H29NO4S MolecularWeight: 487.60986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2)COC3=CC=C(C=C3)C(CCCC4=CC=CC=C4)SCC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2)COC3=CC=C(C=C3)C(CCCC4=CC=CC=C4)SCC(=O)O

InChI

InChI=1S/C29H29NO4S/c1-33-26-16-17-27-23(18-26)10-13-24(30-27)19-34-25-14-11-22(12-15-25)28(35-20-29(31)32)9-5-8-21-6-3-2-4-7-21/h2-4,6-7,10-18,28H,5,8-9,19-20H2,1H3,(H,31,32)