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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-ethylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-ethylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-ethylanilino)-2-oxoethyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[2-(2-ethylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H24N2O3/c1-3-16-6-4-5-7-17(16)21-20(23)14-22(2)13-15-8-9-18-19(12-15)25-11-10-24-18/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,21,23)/p+1