2-[4-[3,4-bis(azanyl)phenyl]-1-methyl-piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-[3,4-bis(azanyl)phenyl]-1-methyl-piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(3,4-diaminophenyl)-1-methyl-piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(3,4-diaminophenyl)-1-methyl-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(3,4-diaminophenyl)-1-methylpiperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(3,4-diaminophenyl)-1-methyl-piperazin-1-ium-1-yl]acetamide Formula: C13H22N5O+ MolecularWeight: 264.34668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N5O/c1-18(9-13(16)19)6-4-17(5-7-18)10-2-3-11(14)12(15)8-10/h2-3,8H,4-7,9,14-15H2,1H3,(H-,16,19)/p+1