[2-[[4-(1,3-benzodioxol-5-ylcarbonylamino)-3-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[4-(1,3-benzodioxol-5-ylcarbonylamino)-3-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[4-(1,3-benzodioxole-5-carbonylamino)-3-methoxy-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-methoxyanilino]-2-oxoethyl]ammonium IUPAC Name: [2-[4-(1,3-benzodioxole-5-carbonylamino)-3-methoxyanilino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[3-methoxy-4-(piperonyloylamino)anilino]ethyl]ammonium Formula: C17H18N3O5+ MolecularWeight: 344.34192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C[NH3+])NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C[NH3+])NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17N3O5/c1-23-14-7-11(19-16(21)8-18)3-4-12(14)20-17(22)10-2-5-13-15(6-10)25-9-24-13/h2-7H,8-9,18H2,1H3,(H,19,21)(H,20,22)/p+1