(2S)-3-methyl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-butan-1-one

Systemtic Name: (2S)-3-methyl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-butan-1-one Openeye Name: (2S)-3-methyl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-butan-1-one CAS Name: (2S)-3-methyl-2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-(1-piperazinyl)-1-butanone IUPAC Name: (2S)-3-methyl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-ylbutan-1-one Traditional Name: (2S)-3-methyl-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazino-butan-1-one Formula: C15H30N3O+ MolecularWeight: 268.4182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1C(C(C)C)C(=O)N2CCNCC2

Isomeric SMILES

C[C@H]1CCCC[NH+]1[C@@H](C(C)C)C(=O)N2CCNCC2

InChI

InChI=1S/C15H29N3O/c1-12(2)14(18-9-5-4-6-13(18)3)15(19)17-10-7-16-8-11-17/h12-14,16H,4-11H2,1-3H3/p+1/t13-,14-/m0/s1