dimethyl-[(2S)-3-methyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium

Systemtic Name: dimethyl-[(2S)-3-methyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium Openeye Name: dimethyl-[(1S)-2-methyl-1-[[(1-propylpiperidin-1-ium-4-yl)amino]methyl]propyl]ammonium CAS Name: dimethyl-[(2S)-3-methyl-1-[(1-propyl-4-piperidin-1-iumyl)amino]butan-2-yl]ammonium IUPAC Name: dimethyl-[(2S)-3-methyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]butan-2-yl]azanium Traditional Name: dimethyl-[(1S)-2-methyl-1-[[(1-propylpiperidin-1-ium-4-yl)amino]methyl]propyl]ammonium Formula: C15H35N3+2 MolecularWeight: 257.4585

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC(C(C)C)[NH+](C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC[C@H](C(C)C)[NH+](C)C

InChI

InChI=1S/C15H33N3/c1-6-9-18-10-7-14(8-11-18)16-12-15(13(2)3)17(4)5/h13-16H,6-12H2,1-5H3/p+2/t15-/m1/s1