[3,4-bis(azanyl)phenyl]-(1-methylpiperazin-1-ium-1-yl)methanone

Systemtic Name: [3,4-bis(azanyl)phenyl]-(1-methylpiperazin-1-ium-1-yl)methanone Openeye Name: (3,4-diaminophenyl)-(1-methylpiperazin-1-ium-1-yl)methanone CAS Name: (3,4-diaminophenyl)-(1-methyl-1-piperazin-1-iumyl)methanone IUPAC Name: (3,4-diaminophenyl)-(1-methylpiperazin-1-ium-1-yl)methanone Traditional Name: (3,4-diaminophenyl)-(1-methylpiperazin-1-ium-1-yl)methanone Formula: C12H19N4O+ MolecularWeight: 235.30546

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C(=O)C2=CC(=C(C=C2)N)N

Isomeric SMILES

C[N+]1(CCNCC1)C(=O)C2=CC(=C(C=C2)N)N

InChI

InChI=1S/C12H18N4O/c1-16(6-4-15-5-7-16)12(17)9-2-3-10(13)11(14)8-9/h2-3,8,15H,4-7,14H2,1H3,(H-,13,17)/p+1