7-methoxy-3-[2-[3-methoxy-4-(3-oxidanylpropoxy)phenyl]ethyl]-2-methyl-isoquinolin-1-one

Systemtic Name: 7-methoxy-3-[2-[3-methoxy-4-(3-oxidanylpropoxy)phenyl]ethyl]-2-methyl-isoquinolin-1-one Openeye Name: 3-[2-[4-(3-hydroxypropoxy)-3-methoxy-phenyl]ethyl]-7-methoxy-2-methyl-isoquinolin-1-one CAS Name: 3-[2-[4-(3-hydroxypropoxy)-3-methoxyphenyl]ethyl]-7-methoxy-2-methyl-1-isoquinolinone IUPAC Name: 3-[2-[4-(3-hydroxypropoxy)-3-methoxyphenyl]ethyl]-7-methoxy-2-methylisoquinolin-1-one Traditional Name: 3-[2-[4-(3-hydroxypropoxy)-3-methoxy-phenyl]ethyl]-7-methoxy-2-methyl-isocarbostyril Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C1=O)C=C(C=C2)OC)CCC3=CC(=C(C=C3)OCCCO)OC

Isomeric SMILES

CN1C(=CC2=C(C1=O)C=C(C=C2)OC)CCC3=CC(=C(C=C3)OCCCO)OC

InChI

InChI=1S/C23H27NO5/c1-24-18(14-17-7-9-19(27-2)15-20(17)23(24)26)8-5-16-6-10-21(22(13-16)28-3)29-12-4-11-25/h6-7,9-10,13-15,25H,4-5,8,11-12H2,1-3H3