4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxo-butanoate CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)amino]-4-oxobutanoate IUPAC Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(4-methylpiperazin-4-ium-1-yl)amino]butyrate Formula: C9H17N3O3 MolecularWeight: 215.24958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C9H17N3O3/c1-11-4-6-12(7-5-11)10-8(13)2-3-9(14)15/h2-7H2,1H3,(H,10,13)(H,14,15)