dimethyl-[(3S)-1-[[(2S)-1-methylazepan-1-ium-2-yl]methyl]piperidin-3-yl]azanium

Systemtic Name: dimethyl-[(3S)-1-[[(2S)-1-methylazepan-1-ium-2-yl]methyl]piperidin-3-yl]azanium Openeye Name: dimethyl-[(3S)-1-[[(2S)-1-methylazepan-1-ium-2-yl]methyl]-3-piperidyl]ammonium CAS Name: dimethyl-[(3S)-1-[[(2S)-1-methyl-2-azepan-1-iumyl]methyl]-3-piperidinyl]ammonium IUPAC Name: dimethyl-[(3S)-1-[[(2S)-1-methylazepan-1-ium-2-yl]methyl]piperidin-3-yl]azanium Traditional Name: dimethyl-[(3S)-1-[[(2S)-1-methylazepan-1-ium-2-yl]methyl]-3-piperidyl]ammonium Formula: C15H33N3+2 MolecularWeight: 255.44262

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCCC1CN2CCCC(C2)[NH+](C)C

Isomeric SMILES

C[NH+]1CCCCC[C@H]1CN2CCC[C@@H](C2)[NH+](C)C

InChI

InChI=1S/C15H31N3/c1-16(2)14-9-7-11-18(12-14)13-15-8-5-4-6-10-17(15)3/h14-15H,4-13H2,1-3H3/p+2/t14-,15-/m0/s1