6-[2-(2-chloranyl-5-nitro-phenyl)-2-oxidanylidene-ethyl]-2,2-dimethyl-1,3-dioxin-4-one

Systemtic Name: 6-[2-(2-chloranyl-5-nitro-phenyl)-2-oxidanylidene-ethyl]-2,2-dimethyl-1,3-dioxin-4-one Openeye Name: 6-[2-(2-chloro-5-nitro-phenyl)-2-oxo-ethyl]-2,2-dimethyl-1,3-dioxin-4-one CAS Name: 6-[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]-2,2-dimethyl-1,3-dioxin-4-one IUPAC Name: 6-[2-(2-chloro-5-nitrophenyl)-2-oxoethyl]-2,2-dimethyl-1,3-dioxin-4-one Traditional Name: 6-[2-(2-chloro-5-nitro-phenyl)-2-keto-ethyl]-2,2-dimethyl-1,3-dioxin-4-one Formula: C14H12ClNO6 MolecularWeight: 325.70118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClNO6/c1-14(2)21-9(7-13(18)22-14)6-12(17)10-5-8(16(19)20)3-4-11(10)15/h3-5,7H,6H2,1-2H3