2-bromanylquinolizin-5-ium-1-ol; (4-methoxyphenyl)azanium; bromide

Systemtic Name: 2-bromanylquinolizin-5-ium-1-ol; (4-methoxyphenyl)azanium; bromide Openeye Name: 2-bromoquinolizin-5-ium-1-ol; (4-methoxyphenyl)ammonium; bromide CAS Name: 2-bromo-1-quinolizin-5-iumol; (4-methoxyphenyl)ammonium; bromide IUPAC Name: 2-bromoquinolizin-5-ium-1-ol; (4-methoxyphenyl)azanium; bromide Traditional Name: 2-bromoquinolizin-5-ium-1-ol; (4-methoxyphenyl)ammonium; bromide Formula: C16H17Br2N2O2+ MolecularWeight: 429.12638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[NH3+].C1=CC=[N+]2C=CC(=C(C2=C1)O)Br.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)[NH3+].C1=CC=[N+]2C=CC(=C(C2=C1)O)Br.[Br-]

InChI

InChI=1S/C9H6BrNO.C7H9NO.BrH/c10-7-4-6-11-5-2-1-3-8(11)9(7)12;1-9-7-4-2-6(8)3-5-7;/h1-6H;2-5H,8H2,1H3;1H/p+1