N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)pyridin-1-ium-3-carbohydrazide

Systemtic Name: N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)pyridin-1-ium-3-carbohydrazide Openeye Name: N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)pyridin-1-ium-3-carbohydrazide CAS Name: N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)-3-pyridin-1-iumcarbohydrazide IUPAC Name: N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)pyridin-1-ium-3-carbohydrazide Traditional Name: N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)pyridin-1-ium-3-carbohydrazide Formula: C19H23N4O3+ MolecularWeight: 355.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=N1)NNC(=O)C3=C[NH+]=CC=C3)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C(=N1)NNC(=O)C3=C[NH+]=CC=C3)OC)OC)C

InChI

InChI=1S/C19H22N4O3/c1-19(2)10-13-8-15(25-3)16(26-4)9-14(13)17(21-19)22-23-18(24)12-6-5-7-20-11-12/h5-9,11H,10H2,1-4H3,(H,21,22)(H,23,24)/p+1