(2-aminophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (2-aminophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (2-aminophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (2-aminophenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2-aminophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (2-aminophenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2N

InChI

InChI=1S/C12H17N3O/c1-14-6-8-15(9-7-14)12(16)10-4-2-3-5-11(10)13/h2-5H,6-9,13H2,1H3/p+1