methyl 3-[4-[(6-methoxy-4-propan-2-yloxy-quinolin-3-yl)methoxy]phenyl]-2-phenylsulfanyl-propanoate

Systemtic Name: methyl 3-[4-[(6-methoxy-4-propan-2-yloxy-quinolin-3-yl)methoxy]phenyl]-2-phenylsulfanyl-propanoate Openeye Name: methyl 3-[4-[(4-isopropoxy-6-methoxy-3-quinolyl)methoxy]phenyl]-2-phenylsulfanyl-propanoate CAS Name: 3-[4-[(6-methoxy-4-propan-2-yloxy-3-quinolinyl)methoxy]phenyl]-2-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(6-methoxy-4-propan-2-yloxyquinolin-3-yl)methoxy]phenyl]-2-phenylsulfanylpropanoate Traditional Name: 3-[4-[(4-isopropoxy-6-methoxy-3-quinolyl)methoxy]phenyl]-2-(phenylthio)propionic acid methyl ester Formula: C30H31NO5S MolecularWeight: 517.63584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C2C=C(C=CC2=NC=C1COC3=CC=C(C=C3)CC(C(=O)OC)SC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)OC1=C2C=C(C=CC2=NC=C1COC3=CC=C(C=C3)CC(C(=O)OC)SC4=CC=CC=C4)OC

InChI

InChI=1S/C30H31NO5S/c1-20(2)36-29-22(18-31-27-15-14-24(33-3)17-26(27)29)19-35-23-12-10-21(11-13-23)16-28(30(32)34-4)37-25-8-6-5-7-9-25/h5-15,17-18,20,28H,16,19H2,1-4H3