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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[(2-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(2-acetylanilino)-2-oxo-ethyl]-(1,3-benzodioxol-5-ylmethyl)-methyl-ammonium CAS Name: [2-(2-acetylanilino)-2-oxoethyl]-(1,3-benzodioxol-5-ylmethyl)-methylammonium IUPAC Name: [2-(2-acetylanilino)-2-oxoethyl]-(1,3-benzodioxol-5-ylmethyl)-methylazanium Traditional Name: [2-(2-acetylanilino)-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C19H21N2O4+ MolecularWeight: 341.38104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4/c1-13(22)15-5-3-4-6-16(15)20-19(23)11-21(2)10-14-7-8-17-18(9-14)25-12-24-17/h3-9H,10-12H2,1-2H3,(H,20,23)/p+1