2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)ethanoic acid bromide

Systemtic Name: 2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)ethanoic acid bromide Openeye Name: 2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)acetic acid bromide CAS Name: 2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)acetic acid bromide IUPAC Name: 2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)acetic acid bromide Traditional Name: 2-(2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-4-ium-3-yl)acetic acid bromide Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC3=CC=CC=C3[NH+]=C2C(N1)CC(=O)O.[Br-]

Isomeric SMILES

C1C2=CC3=CC=CC=C3[NH+]=C2C(N1)CC(=O)O.[Br-]

InChI

InChI=1S/C13H12N2O2.BrH/c16-12(17)6-11-13-9(7-14-11)5-8-3-1-2-4-10(8)15-13;/h1-5,11,14H,6-7H2,(H,16,17);1H