5-bromanyl-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)furan-2-carbohydrazide

Systemtic Name: 5-bromanyl-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)furan-2-carbohydrazide Openeye Name: 5-bromo-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)furan-2-carbohydrazide CAS Name: 5-bromo-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)-2-furancarbohydrazide IUPAC Name: 5-bromo-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)furan-2-carbohydrazide Traditional Name: 5-bromo-N'-(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-2-ium-1-yl)-2-furohydrazide Formula: C18H21BrN3O4+ MolecularWeight: 423.28104

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=[NH+]1)NNC(=O)C3=CC=C(O3)Br)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C(=[NH+]1)NNC(=O)C3=CC=C(O3)Br)OC)OC)C

InChI

InChI=1S/C18H20BrN3O4/c1-18(2)9-10-7-13(24-3)14(25-4)8-11(10)16(20-18)21-22-17(23)12-5-6-15(19)26-12/h5-8H,9H2,1-4H3,(H,20,21)(H,22,23)/p+1