[3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]methylazanium

Systemtic Name: [3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenyl]methylazanium Openeye Name: [3-[(4-benzylpiperidin-1-ium-1-yl)methyl]phenyl]methylammonium CAS Name: [3-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]phenyl]methylammonium IUPAC Name: [3-[(4-benzylpiperidin-1-ium-1-yl)methyl]phenyl]methylazanium Traditional Name: [3-[(4-benzylpiperidin-1-ium-1-yl)methyl]benzyl]ammonium Formula: C20H28N2+2 MolecularWeight: 296.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)C[NH3+]

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=CC(=CC=C3)C[NH3+]

InChI

InChI=1S/C20H26N2/c21-15-19-7-4-8-20(14-19)16-22-11-9-18(10-12-22)13-17-5-2-1-3-6-17/h1-8,14,18H,9-13,15-16,21H2/p+2