1-[6-[azanyl(isoquinolin-1-yl)methyl]-2,3-dimethoxy-phenyl]-2-(methylamino)propan-1-one

Systemtic Name: 1-[6-[azanyl(isoquinolin-1-yl)methyl]-2,3-dimethoxy-phenyl]-2-(methylamino)propan-1-one Openeye Name: 1-[6-[amino(1-isoquinolyl)methyl]-2,3-dimethoxy-phenyl]-2-(methylamino)propan-1-one CAS Name: 1-[6-[amino(1-isoquinolinyl)methyl]-2,3-dimethoxyphenyl]-2-(methylamino)-1-propanone IUPAC Name: 1-[6-[amino(isoquinolin-1-yl)methyl]-2,3-dimethoxyphenyl]-2-(methylamino)propan-1-one Traditional Name: 1-[6-[amino(1-isoquinolyl)methyl]-2,3-dimethoxy-phenyl]-2-(methylamino)propan-1-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=C(C=CC(=C1OC)OC)C(C2=NC=CC3=CC=CC=C32)N)NC

Isomeric SMILES

CC(C(=O)C1=C(C=CC(=C1OC)OC)C(C2=NC=CC3=CC=CC=C32)N)NC

InChI

InChI=1S/C22H25N3O3/c1-13(24-2)21(26)18-16(9-10-17(27-3)22(18)28-4)19(23)20-15-8-6-5-7-14(15)11-12-25-20/h5-13,19,24H,23H2,1-4H3