2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzoxazol-5-amine

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzoxazol-5-amine Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzoxazol-5-amine CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-1,3-benzoxazol-5-amine IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzoxazol-5-amine Traditional Name: [2-(4-methylpiperazin-4-ium-1-yl)-1,3-benzoxazol-5-yl]amine Formula: C12H17N4O+ MolecularWeight: 233.28958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC3=C(O2)C=CC(=C3)N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=C(O2)C=CC(=C3)N

InChI

InChI=1S/C12H16N4O/c1-15-4-6-16(7-5-15)12-14-10-8-9(13)2-3-11(10)17-12/h2-3,8H,4-7,13H2,1H3/p+1