[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-pentan-3-yl-azanium

Systemtic Name: [2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: [2-(4-methyl-1-piperazinyl)-2-oxoethyl]-pentan-3-ylammonium IUPAC Name: [2-(4-methylpiperazin-1-yl)-2-oxoethyl]-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[2-keto-2-(4-methylpiperazino)ethyl]ammonium Formula: C12H26N3O+ MolecularWeight: 228.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC(=O)N1CCN(CC1)C

Isomeric SMILES

CCC(CC)[NH2+]CC(=O)N1CCN(CC1)C

InChI

InChI=1S/C12H25N3O/c1-4-11(5-2)13-10-12(16)15-8-6-14(3)7-9-15/h11,13H,4-10H2,1-3H3/p+1