7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide

Systemtic Name: 7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide Openeye Name: 7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide CAS Name: 7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide IUPAC Name: 7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide Traditional Name: 7-nitro-1,2,3,4-tetrahydroisoquinolin-2-ium bromide Formula: C9H11BrN2O2 MolecularWeight: 259.09984

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC2=C1C=CC(=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1C[NH2+]CC2=C1C=CC(=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C9H10N2O2.BrH/c12-11(13)9-2-1-7-3-4-10-6-8(7)5-9;/h1-2,5,10H,3-4,6H2;1H