(3-cyanophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium

Systemtic Name: (3-cyanophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Openeye Name: (3-cyanophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium CAS Name: (3-cyanophenyl)methyl-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]ammonium IUPAC Name: (3-cyanophenyl)methyl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]azanium Traditional Name: (3-cyanobenzyl)-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C17H27N3+2 MolecularWeight: 273.41638

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]CC2=CC=CC(=C2)C#N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+]CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H25N3/c1-15-6-2-3-10-20(15)11-5-9-19-14-17-8-4-7-16(12-17)13-18/h4,7-8,12,15,19H,2-3,5-6,9-11,14H2,1H3/p+2/t15-/m0/s1