4-[3-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzenecarbonitrile Openeye Name: 4-[3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzonitrile CAS Name: 4-[3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzonitrile IUPAC Name: 4-[3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzonitrile Traditional Name: 4-[3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]benzonitrile Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(CC(C2=C(C=C1)OC)O)CCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=C2CN(CC(C2=C(C=C1)OC)O)CCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H24N2O4/c1-25-19-8-9-20(26-2)21-17(19)13-23(14-18(21)24)10-3-11-27-16-6-4-15(12-22)5-7-16/h4-9,18,24H,3,10-11,13-14H2,1-2H3