(3-cyanophenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-cyanophenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-cyanophenyl)methyl-(1-isopropylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-cyanophenyl)methyl-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-cyanophenyl)methyl-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-cyanobenzyl)-(1-isopropylpiperidin-1-ium-4-yl)ammonium Formula: C16H25N3+2 MolecularWeight: 259.3898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH2+]CC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H23N3/c1-13(2)19-8-6-16(7-9-19)18-12-15-5-3-4-14(10-15)11-17/h3-5,10,13,16,18H,6-9,12H2,1-2H3/p+2