3-bromanyl-1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-5-nitro-pyridin-2-one

Systemtic Name: 3-bromanyl-1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-5-nitro-pyridin-2-one Openeye Name: 3-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-5-nitro-pyridin-2-one CAS Name: 3-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-5-nitro-2-pyridinone IUPAC Name: 3-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)-5-nitropyridin-2-one Traditional Name: 3-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-5-nitro-2-pyridone Formula: C16H14BrN3O7 MolecularWeight: 440.20226

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=C(C=C(C3=O)Br)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=C(C=C(C3=O)Br)[N+](=O)[O-])O)C

InChI

InChI=1S/C16H14BrN3O7/c1-16(2)14(21)13(10-5-8(19(23)24)3-4-12(10)27-16)18-7-9(20(25)26)6-11(17)15(18)22/h3-7,13-14,21H,1-2H3