methyl-phenethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: methyl-phenethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-methyl-phenethyl-ammonium CAS Name: methyl-phenethyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-methyl-phenethylazanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-methyl-phenethyl-ammonium Formula: C21H30N2+2 MolecularWeight: 310.4763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N2/c1-22(15-12-19-8-4-2-5-9-19)21-13-16-23(17-14-21)18-20-10-6-3-7-11-20/h2-11,21H,12-18H2,1H3/p+2