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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxidanylidene-2-[[2-[(phenylmethyl)carbamoyl]phenyl]amino]ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(benzylcarbamoyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[2-[oxo-[(phenylmethyl)amino]methyl]anilino]ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(benzylcarbamoyl)anilino]-2-oxoethyl]-methylazanium Traditional Name: [2-[2-(benzylcarbamoyl)anilino]-2-keto-ethyl]-methyl-piperonyl-ammonium Formula: C25H26N3O4+ MolecularWeight: 432.49164

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c1-28(15-19-11-12-22-23(13-19)32-17-31-22)16-24(29)27-21-10-6-5-9-20(21)25(30)26-14-18-7-3-2-4-8-18/h2-13H,14-17H2,1H3,(H,26,30)(H,27,29)/p+1