2-methyl-1-[(3S)-3-piperazin-4-ium-1-ylcarbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[(3S)-3-piperazin-4-ium-1-ylcarbonylpiperidin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[(3S)-3-(piperazin-4-ium-1-carbonyl)-1-piperidyl]propan-1-one CAS Name: 2-methyl-1-[(3S)-3-[oxo(1-piperazin-4-iumyl)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 2-methyl-1-[(3S)-3-(piperazin-4-ium-1-carbonyl)piperidin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[(3S)-3-(piperazin-4-ium-1-carbonyl)piperidino]propan-1-one Formula: C14H26N3O2+ MolecularWeight: 268.37514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)C(=O)N1CCC[C@@H](C1)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C14H25N3O2/c1-11(2)13(18)17-7-3-4-12(10-17)14(19)16-8-5-15-6-9-16/h11-12,15H,3-10H2,1-2H3/p+1/t12-/m0/s1