N-[5-bromanyl-1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridin-3-yl]ethanamide

Systemtic Name: N-[5-bromanyl-1-(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-2-oxidanylidene-pyridin-3-yl]ethanamide Openeye Name: N-[5-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-2-oxo-3-pyridyl]acetamide CAS Name: N-[5-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-2-oxo-3-pyridinyl]acetamide IUPAC Name: N-[5-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)-2-oxopyridin-3-yl]acetamide Traditional Name: N-[5-bromo-1-(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)-2-keto-3-pyridyl]acetamide Formula: C18H18BrN3O6 MolecularWeight: 452.25602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CN(C1=O)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)Br

Isomeric SMILES

CC(=O)NC1=CC(=CN(C1=O)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(C)C)O)Br

InChI

InChI=1S/C18H18BrN3O6/c1-9(23)20-13-6-10(19)8-21(17(13)25)15-12-7-11(22(26)27)4-5-14(12)28-18(2,3)16(15)24/h4-8,15-16,24H,1-3H3,(H,20,23)