3-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenyl-butyl]sulfanylpropanoic acid

Systemtic Name: 3-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenyl-butyl]sulfanylpropanoic acid Openeye Name: 3-[1-[4-[(6-methoxy-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]sulfanylpropanoic acid CAS Name: 3-[[1-[4-[(6-methoxy-2-quinolinyl)methoxy]phenyl]-4-phenylbutyl]thio]propanoic acid IUPAC Name: 3-[1-[4-[(6-methoxyquinolin-2-yl)methoxy]phenyl]-4-phenylbutyl]sulfanylpropanoic acid Traditional Name: 3-[[1-[4-[(6-methoxy-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]thio]propionic acid Formula: C30H31NO4S MolecularWeight: 501.63644

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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)SCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C30H31NO4S/c1-34-27-16-17-28-24(20-27)10-13-25(31-28)21-35-26-14-11-23(12-15-26)29(36-19-18-30(32)33)9-5-8-22-6-3-2-4-7-22/h2-4,6-7,10-17,20,29H,5,8-9,18-19,21H2,1H3,(H,32,33)