1,3-benzodioxol-5-ylmethyl-methyl-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[4-(2-oxo-1-pyrrolidinyl)anilino]ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-methyl-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]azanium Traditional Name: [2-keto-2-[4-(2-ketopyrrolidino)anilino]ethyl]-methyl-piperonyl-ammonium Formula: C21H24N3O4+ MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C21H23N3O4/c1-23(12-15-4-9-18-19(11-15)28-14-27-18)13-20(25)22-16-5-7-17(8-6-16)24-10-2-3-21(24)26/h4-9,11H,2-3,10,12-14H2,1H3,(H,22,25)/p+1