1-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(diphenylmethyl)oxy-piperidin-1-ium

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(diphenylmethyl)oxy-piperidin-1-ium Openeye Name: 1-benzhydryloxy-1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-1-ium CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(diphenylmethyl)oxypiperidin-1-ium IUPAC Name: 1-benzhydryloxy-1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-1-ium Traditional Name: 1-benzhydryloxy-1-homopiperonyl-piperidin-1-ium Formula: C27H30NO3+ MolecularWeight: 416.532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CCC2=CC3=C(C=C2)OCO3)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC[N+](CC1)(CCC2=CC3=C(C=C2)OCO3)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H30NO3/c1-4-10-23(11-5-1)27(24-12-6-2-7-13-24)31-28(17-8-3-9-18-28)19-16-22-14-15-25-26(20-22)30-21-29-25/h1-2,4-7,10-15,20,27H,3,8-9,16-19,21H2/q+1