2-azanyl-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinolin-3-one hydrochloride

Systemtic Name: 2-azanyl-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinolin-3-one hydrochloride Openeye Name: 2-amino-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinolin-3-one hydrochloride CAS Name: 2-amino-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3-isoquinolinone hydrochloride IUPAC Name: 2-amino-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinolin-3-one hydrochloride Traditional Name: 2-amino-6,7-dimethoxy-1-veratryl-3-isoquinolone hydrochloride Formula: C20H23ClN2O5 MolecularWeight: 406.86002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=C3C=C(C(=CC3=CC(=O)N2N)OC)OC)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=C3C=C(C(=CC3=CC(=O)N2N)OC)OC)OC.Cl

InChI

InChI=1S/C20H22N2O5.ClH/c1-24-16-6-5-12(8-17(16)25-2)7-15-14-11-19(27-4)18(26-3)9-13(14)10-20(23)22(15)21;/h5-6,8-11H,7,21H2,1-4H3;1H