ethyl 4-(4-chloranyl-2-nitro-phenyl)carbonyl-2,6-dimethyl-3,5-bis(oxidanylidene)oxane-2-carboxylate

Systemtic Name: ethyl 4-(4-chloranyl-2-nitro-phenyl)carbonyl-2,6-dimethyl-3,5-bis(oxidanylidene)oxane-2-carboxylate Openeye Name: ethyl 4-(4-chloro-2-nitro-benzoyl)-2,6-dimethyl-3,5-dioxo-tetrahydropyran-2-carboxylate CAS Name: 4-[(4-chloro-2-nitrophenyl)-oxomethyl]-2,6-dimethyl-3,5-dioxo-2-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chloro-2-nitrobenzoyl)-2,6-dimethyl-3,5-dioxooxane-2-carboxylate Traditional Name: 4-(4-chloro-2-nitro-benzoyl)-3,5-diketo-2,6-dimethyl-tetrahydropyran-2-carboxylic acid ethyl ester Formula: C17H16ClNO8 MolecularWeight: 397.76384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)C(C(=O)C(O1)C)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1(C(=O)C(C(=O)C(O1)C)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C17H16ClNO8/c1-4-26-16(23)17(3)15(22)12(13(20)8(2)27-17)14(21)10-6-5-9(18)7-11(10)19(24)25/h5-8,12H,4H2,1-3H3