[(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-methyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-oxidanyl-propyl]-methyl-[(2-methylphenyl)methyl]azanium Openeye Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxy-propyl]-methyl-(o-tolylmethyl)ammonium CAS Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [(2R)-3-(1,3-benzodioxol-5-ylmethoxy)-2-hydroxypropyl]-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [(2R)-2-hydroxy-3-piperonyloxy-propyl]-methyl-(2-methylbenzyl)ammonium Formula: C20H26NO4+ MolecularWeight: 344.42474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CC(COCC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)C[C@H](COCC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C20H25NO4/c1-15-5-3-4-6-17(15)10-21(2)11-18(22)13-23-12-16-7-8-19-20(9-16)25-14-24-19/h3-9,18,22H,10-14H2,1-2H3/p+1/t18-/m1/s1