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

Systemtic Name: ethyl 3-(4-chloranyl-2-nitro-phenyl)carbonyloxy-2,6-dimethyl-5-oxidanylidene-oxane-2-carboxylate Openeye Name: ethyl 3-(4-chloro-2-nitro-benzoyl)oxy-2,6-dimethyl-5-oxo-tetrahydropyran-2-carboxylate CAS Name: 3-[(4-chloro-2-nitrophenyl)-oxomethoxy]-2,6-dimethyl-5-oxo-2-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chloro-2-nitrobenzoyl)oxy-2,6-dimethyl-5-oxooxane-2-carboxylate Traditional Name: 3-(4-chloro-2-nitro-benzoyl)oxy-5-keto-2,6-dimethyl-tetrahydropyran-2-carboxylic acid ethyl ester Formula: C17H18ClNO8 MolecularWeight: 399.77972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18ClNO8/c1-4-25-16(22)17(3)14(8-13(20)9(2)27-17)26-15(21)11-6-5-10(18)7-12(11)19(23)24/h5-7,9,14H,4,8H2,1-3H3