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

Systemtic Name: [2-[[5-(1,3-benzodioxol-5-ylcarbonylamino)-2-ethyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[5-(1,3-benzodioxole-5-carbonylamino)-2-ethyl-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-2-ethylanilino]-2-oxoethyl]ammonium IUPAC Name: [2-[5-(1,3-benzodioxole-5-carbonylamino)-2-ethylanilino]-2-oxoethyl]azanium Traditional Name: [2-[2-ethyl-5-(piperonyloylamino)anilino]-2-keto-ethyl]ammonium Formula: C18H20N3O4+ MolecularWeight: 342.3691

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)NC(=O)C[NH3+]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)NC(=O)C[NH3+]

InChI

InChI=1S/C18H19N3O4/c1-2-11-3-5-13(8-14(11)21-17(22)9-19)20-18(23)12-4-6-15-16(7-12)25-10-24-15/h3-8H,2,9-10,19H2,1H3,(H,20,23)(H,21,22)/p+1