1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline-1-carbonitrile

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline-1-carbonitrile Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline-1-carbonitrile CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline-1-carbonitrile IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-2H-isoquinoline-1-carbonitrile Traditional Name: 6,7-dimethoxy-1-veratryl-3,4-dihydro-2H-isoquinoline-1-carbonitrile Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2(C3=CC(=C(C=C3CCN2)OC)OC)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2(C3=CC(=C(C=C3CCN2)OC)OC)C#N)OC

InChI

InChI=1S/C21H24N2O4/c1-24-17-6-5-14(9-18(17)25-2)12-21(13-22)16-11-20(27-4)19(26-3)10-15(16)7-8-23-21/h5-6,9-11,23H,7-8,12H2,1-4H3