methyl 4-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(2,2-dimethyl-3-oxidanylidene-4H-quinoxalin-1-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-(3-keto-2,2-dimethyl-4H-quinoxalin-1-yl)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C20H19N3O7 MolecularWeight: 413.38076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N3O7/c1-20(2)19(26)21-13-6-4-5-7-14(13)22(20)17(24)11-30-16-9-8-12(18(25)29-3)10-15(16)23(27)28/h4-10H,11H2,1-3H3,(H,21,26)