(3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-3,4-dihydrochromen-3-ol

Systemtic Name: (3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-3,4-dihydrochromen-3-ol Openeye Name: (3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-chroman-3-ol CAS Name: (3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: (3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-3,4-dihydrochromen-3-ol Traditional Name: (3S,4R)-2,2-dimethyl-4-(methylamino)-6-nitro-chroman-3-ol Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4/c1-12(2)11(15)10(13-3)8-6-7(14(16)17)4-5-9(8)18-12/h4-6,10-11,13,15H,1-3H3/t10-,11+/m1/s1