[2-oxidanylidene-2-(3-oxidanylidenespiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-oxidanylidenespiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(3-oxospiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-oxo-2-(3-oxo-1-spiro[4H-quinoxaline-2,1'-cyclopentane]yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-oxospiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-keto-2-(3-ketospiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] ester Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2C3=CC=CC=C3NC(=O)C24CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2C3=CC=CC=C3NC(=O)C24CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6/c1-14-8-9-15(12-18(14)25(29)30)20(27)31-13-19(26)24-17-7-3-2-6-16(17)23-21(28)22(24)10-4-5-11-22/h2-3,6-9,12H,4-5,10-11,13H2,1H3,(H,23,28)