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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-(2-ethoxycarbonylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-(2-ethoxycarbonylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-(2-ethoxycarbonylanilino)-2-oxoethyl]-methylazanium Traditional Name: [2-(2-carbethoxyanilino)-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C20H23N2O5+ MolecularWeight: 371.40702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C[NH+](C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H22N2O5/c1-3-25-20(24)15-6-4-5-7-16(15)21-19(23)12-22(2)11-14-8-9-17-18(10-14)27-13-26-17/h4-10H,3,11-13H2,1-2H3,(H,21,23)/p+1