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

Systemtic Name: 1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-5-(hydroxymethyl)pyrrolidin-2-one Openeye Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-5-(hydroxymethyl)pyrrolidin-2-one CAS Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-5-(hydroxymethyl)-2-pyrrolidinone IUPAC Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)-5-(hydroxymethyl)pyrrolidin-2-one Traditional Name: 1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-5-methylol-2-pyrrolidone Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C(CCC3=O)CO)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3C(CCC3=O)CO)O)C

InChI

InChI=1S/C16H20N2O6/c1-16(2)15(21)14(17-10(8-19)4-6-13(17)20)11-7-9(18(22)23)3-5-12(11)24-16/h3,5,7,10,14-15,19,21H,4,6,8H2,1-2H3