4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxo-but-2-enoate CAS Name: 4-[(4-methyl-1-piperazin-4-iumyl)amino]-4-oxo-2-butenoate IUPAC Name: 4-[(4-methylpiperazin-4-ium-1-yl)amino]-4-oxobut-2-enoate Traditional Name: 4-keto-4-[(4-methylpiperazin-4-ium-1-yl)amino]but-2-enoate Formula: C9H15N3O3 MolecularWeight: 213.2337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15N3O3/c1-11-4-6-12(7-5-11)10-8(13)2-3-9(14)15/h2-3H,4-7H2,1H3,(H,10,13)(H,14,15)