[(3S,4R)-2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyridin-1-yl)-3,4-dihydrochromen-3-yl] methanoate

Systemtic Name: [(3S,4R)-2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyridin-1-yl)-3,4-dihydrochromen-3-yl] methanoate Openeye Name: [(3S,4R)-2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridyl)chroman-3-yl] formate CAS Name: formic acid [(3S,4R)-2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridinyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(3S,4R)-2,2-dimethyl-6-nitro-4-(2-oxopyridin-1-yl)-3,4-dihydrochromen-3-yl] formate Traditional Name: formic acid [(3S,4R)-4-(2-keto-1-pyridyl)-2,2-dimethyl-6-nitro-chroman-3-yl] ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=CC=CC3=O)OC=O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C=CC=CC3=O)OC=O)C

InChI

InChI=1S/C17H16N2O6/c1-17(2)16(24-10-20)15(18-8-4-3-5-14(18)21)12-9-11(19(22)23)6-7-13(12)25-17/h3-10,15-16H,1-2H3/t15-,16+/m1/s1