3-methyl-1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]butan-1-one

Systemtic Name: 3-methyl-1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)-1-piperidyl]butan-1-one CAS Name: 3-methyl-1-[(3R)-3-(1-piperazin-4-iumylmethyl)-1-piperidinyl]-1-butanone IUPAC Name: 3-methyl-1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[(3R)-3-(piperazin-4-ium-1-ylmethyl)piperidino]butan-1-one Formula: C15H30N3O+ MolecularWeight: 268.4182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCCC(C1)CN2CC[NH2+]CC2

Isomeric SMILES

CC(C)CC(=O)N1CCC[C@@H](C1)CN2CC[NH2+]CC2

InChI

InChI=1S/C15H29N3O/c1-13(2)10-15(19)18-7-3-4-14(12-18)11-17-8-5-16-6-9-17/h13-14,16H,3-12H2,1-2H3/p+1/t14-/m1/s1