2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-(o-tolylmethylamino)-2-oxo-ethyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-keto-2-[(2-methylbenzyl)amino]ethyl]-methyl-ammonium Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H24N2O3/c1-15-5-3-4-6-17(15)12-21-20(23)14-22(2)13-16-7-8-18-19(11-16)25-10-9-24-18/h3-8,11H,9-10,12-14H2,1-2H3,(H,21,23)/p+1