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

Systemtic Name: phenethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-phenethyl-ammonium CAS Name: phenethyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-phenethylazanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-phenethyl-ammonium Formula: C20H28N2+2 MolecularWeight: 296.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2/c1-3-7-18(8-4-1)11-14-21-20-12-15-22(16-13-20)17-19-9-5-2-6-10-19/h1-10,20-21H,11-17H2/p+2