1-[(3S,4R)-2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]pyridin-2-one

Systemtic Name: 1-[(3S,4R)-2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]pyridin-2-one Openeye Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl]pyridin-2-one CAS Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyridinone IUPAC Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl]pyridin-2-one Traditional Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl]-2-pyridone Formula: C16H16N2O5 MolecularWeight: 316.30864

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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)O)C

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O5/c1-16(2)15(20)14(17-8-4-3-5-13(17)19)11-9-10(18(21)22)6-7-12(11)23-16/h3-9,14-15,20H,1-2H3/t14-,15+/m1/s1