1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxy-propoxy]phenyl]propan-1-one Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCC3=CC(=C(C=C3C2)OC)OC)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCC3=CC(=C(C=C3C2)OC)OC)O

InChI

InChI=1S/C23H29NO5/c1-4-21(26)16-5-7-20(8-6-16)29-15-19(25)14-24-10-9-17-11-22(27-2)23(28-3)12-18(17)13-24/h5-8,11-12,19,25H,4,9-10,13-15H2,1-3H3