1,3-benzodioxol-5-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-(o-tolylmethylamino)-2-oxo-ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[(2-methylbenzyl)amino]ethyl]-methyl-piperonyl-ammonium Formula: C19H23N2O3+ MolecularWeight: 327.39752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O3/c1-14-5-3-4-6-16(14)10-20-19(22)12-21(2)11-15-7-8-17-18(9-15)24-13-23-17/h3-9H,10-13H2,1-2H3,(H,20,22)/p+1