1,3-benzodioxol-5-ylmethyl-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethyl]-methylazanium Traditional Name: [2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethyl]-methyl-piperonyl-ammonium Formula: C21H24N3O4+ MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)C[NH+](C)CC3=CC4=C(C=C3)OCO4)C

InChI

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