4-[(3,4-dimethoxyphenyl)methyl]isoquinoline

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]isoquinoline Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]isoquinoline CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]isoquinoline IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]isoquinoline Traditional Name: 4-veratrylisoquinoline Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=CN=CC3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=CN=CC3=CC=CC=C32)OC

InChI

InChI=1S/C18H17NO2/c1-20-17-8-7-13(10-18(17)21-2)9-15-12-19-11-14-5-3-4-6-16(14)15/h3-8,10-12H,9H2,1-2H3