1,3-benzodioxol-5-ylmethyl-[[2-[(4-methylphenyl)methoxy]naphthalen-1-yl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[2-[(4-methylphenyl)methoxy]naphthalen-1-yl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[[2-(p-tolylmethoxy)-1-naphthyl]methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[2-[(4-methylphenyl)methoxy]-1-naphthalenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[2-[(4-methylphenyl)methoxy]naphthalen-1-yl]methyl]azanium Traditional Name: [2-(4-methylbenzyl)oxy-1-naphthyl]methyl-piperonyl-ammonium Formula: C27H26NO3+ MolecularWeight: 412.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C=C2)C[NH2+]CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C=C2)C[NH2+]CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25NO3/c1-19-6-8-20(9-7-19)17-29-25-13-11-22-4-2-3-5-23(22)24(25)16-28-15-21-10-12-26-27(14-21)31-18-30-26/h2-14,28H,15-18H2,1H3/p+1