1-(3-chloranyl-4,5-dimethoxy-phenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile

Systemtic Name: 1-(3-chloranyl-4,5-dimethoxy-phenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Openeye Name: 1-(3-chloro-4,5-dimethoxy-phenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile CAS Name: 1-(3-chloro-4,5-dimethoxyphenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile IUPAC Name: 1-(3-chloro-4,5-dimethoxyphenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Traditional Name: 1-(3-chloro-4,5-dimethoxy-phenyl)-5,6-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(N(CC2)C#N)C3=CC(=C(C(=C3)Cl)OC)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(N(CC2)C#N)C3=CC(=C(C(=C3)Cl)OC)OC)OC

InChI

InChI=1S/C20H21ClN2O4/c1-24-16-6-5-13-14(19(16)26-3)7-8-23(11-22)18(13)12-9-15(21)20(27-4)17(10-12)25-2/h5-6,9-10,18H,7-8H2,1-4H3