3-methyl-1-piperazin-4-ium-1-yl-but-2-en-1-one

Systemtic Name: 3-methyl-1-piperazin-4-ium-1-yl-but-2-en-1-one Openeye Name: 3-methyl-1-piperazin-4-ium-1-yl-but-2-en-1-one CAS Name: 3-methyl-1-(1-piperazin-4-iumyl)-2-buten-1-one IUPAC Name: 3-methyl-1-piperazin-4-ium-1-ylbut-2-en-1-one Traditional Name: 3-methyl-1-piperazin-4-ium-1-yl-but-2-en-1-one Formula: C9H17N2O+ MolecularWeight: 169.24408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CC[NH2+]CC1)C

Isomeric SMILES

CC(=CC(=O)N1CC[NH2+]CC1)C

InChI

InChI=1S/C9H16N2O/c1-8(2)7-9(12)11-5-3-10-4-6-11/h7,10H,3-6H2,1-2H3/p+1