(4-bromanyl-1-methyl-pyrrol-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (4-bromanyl-1-methyl-pyrrol-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-bromo-1-methyl-pyrrol-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (4-bromo-1-methyl-2-pyrrolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4-bromo-1-methylpyrrol-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-bromo-1-methyl-pyrrol-2-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C11H17BrN3O+ MolecularWeight: 287.17618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC(=CN2C)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC(=CN2C)Br

InChI

InChI=1S/C11H16BrN3O/c1-13-3-5-15(6-4-13)11(16)10-7-9(12)8-14(10)2/h7-8H,3-6H2,1-2H3/p+1