6,7-dimethoxy-2-piperidin-3-yl-2H-isoquinolin-2-ium-1-one chloride

Systemtic Name: 6,7-dimethoxy-2-piperidin-3-yl-2H-isoquinolin-2-ium-1-one chloride Openeye Name: 6,7-dimethoxy-2-(3-piperidyl)-2H-isoquinolin-2-ium-1-one chloride CAS Name: 6,7-dimethoxy-2-(3-piperidinyl)-2H-isoquinolin-2-ium-1-one chloride IUPAC Name: 6,7-dimethoxy-2-piperidin-3-yl-2H-isoquinolin-2-ium-1-one chloride Traditional Name: 6,7-dimethoxy-2-(3-piperidyl)-2H-isoquinolin-2-ium-1-one chloride Formula: C16H21ClN2O3 MolecularWeight: 324.80254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C[NH+](C2=O)C3CCCNC3)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C[NH+](C2=O)C3CCCNC3)OC.[Cl-]

InChI

InChI=1S/C16H20N2O3.ClH/c1-20-14-8-11-5-7-18(12-4-3-6-17-10-12)16(19)13(11)9-15(14)21-2;/h5,7-9,12,17H,3-4,6,10H2,1-2H3;1H