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

Systemtic Name: 3-[4-phenyl-1-[4-[(6-propan-2-ylquinolin-2-yl)methoxy]phenyl]butyl]sulfanylpropanoic acid Openeye Name: 3-[1-[4-[(6-isopropyl-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]sulfanylpropanoic acid CAS Name: 3-[[4-phenyl-1-[4-[(6-propan-2-yl-2-quinolinyl)methoxy]phenyl]butyl]thio]propanoic acid IUPAC Name: 3-[4-phenyl-1-[4-[(6-propan-2-ylquinolin-2-yl)methoxy]phenyl]butyl]sulfanylpropanoic acid Traditional Name: 3-[[1-[4-[(6-isopropyl-2-quinolyl)methoxy]phenyl]-4-phenyl-butyl]thio]propionic acid Formula: C32H35NO3S MolecularWeight: 513.6902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H35NO3S/c1-23(2)26-14-18-30-27(21-26)11-15-28(33-30)22-36-29-16-12-25(13-17-29)31(37-20-19-32(34)35)10-6-9-24-7-4-3-5-8-24/h3-5,7-8,11-18,21,23,31H,6,9-10,19-20,22H2,1-2H3,(H,34,35)