[2-oxidanylidene-2-(3-oxidanylidenespiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 2-azanyl-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-oxidanylidenespiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 2-azanyl-5-nitro-benzoate Openeye Name: [2-oxo-2-(3-oxospiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-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] 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid [2-keto-2-(3-ketospiro[4H-quinoxaline-2,1'-cyclopentane]-1-yl)ethyl] ester Formula: C21H20N4O6 MolecularWeight: 424.4067

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(=O)NC3=CC=CC=C3N2C(=O)COC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N

Isomeric SMILES

C1CCC2(C1)C(=O)NC3=CC=CC=C3N2C(=O)COC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N

InChI

InChI=1S/C21H20N4O6/c22-15-8-7-13(25(29)30)11-14(15)19(27)31-12-18(26)24-17-6-2-1-5-16(17)23-20(28)21(24)9-3-4-10-21/h1-2,5-8,11H,3-4,9-10,12,22H2,(H,23,28)