4-(4-chloranyl-2-nitro-phenyl)carbonyl-5-methoxy-2,2,6,6-tetramethyl-pyran-3-one

Systemtic Name: 4-(4-chloranyl-2-nitro-phenyl)carbonyl-5-methoxy-2,2,6,6-tetramethyl-pyran-3-one Openeye Name: 4-(4-chloro-2-nitro-benzoyl)-5-methoxy-2,2,6,6-tetramethyl-pyran-3-one CAS Name: 4-[(4-chloro-2-nitrophenyl)-oxomethyl]-5-methoxy-2,2,6,6-tetramethyl-3-pyranone IUPAC Name: 4-(4-chloro-2-nitrobenzoyl)-5-methoxy-2,2,6,6-tetramethylpyran-3-one Traditional Name: 4-(4-chloro-2-nitro-benzoyl)-5-methoxy-2,2,6,6-tetramethyl-pyran-3-one Formula: C17H18ClNO6 MolecularWeight: 367.78092

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)C(O1)(C)C)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1(C(=C(C(=O)C(O1)(C)C)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC)C

InChI

InChI=1S/C17H18ClNO6/c1-16(2)14(21)12(15(24-5)17(3,4)25-16)13(20)10-7-6-9(18)8-11(10)19(22)23/h6-8H,1-5H3