2,2-dimethyl-7-[2-(3-nitrophenyl)-2-oxidanylidene-ethoxy]-5-oxidanyl-3H-chromen-4-one

Systemtic Name: 2,2-dimethyl-7-[2-(3-nitrophenyl)-2-oxidanylidene-ethoxy]-5-oxidanyl-3H-chromen-4-one Openeye Name: 5-hydroxy-2,2-dimethyl-7-[2-(3-nitrophenyl)-2-oxo-ethoxy]chroman-4-one CAS Name: 5-hydroxy-2,2-dimethyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 5-hydroxy-2,2-dimethyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-3H-chromen-4-one Traditional Name: 5-hydroxy-7-[2-keto-2-(3-nitrophenyl)ethoxy]-2,2-dimethyl-chroman-4-one Formula: C19H17NO7 MolecularWeight: 371.34078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C19H17NO7/c1-19(2)9-15(22)18-14(21)7-13(8-17(18)27-19)26-10-16(23)11-4-3-5-12(6-11)20(24)25/h3-8,21H,9-10H2,1-2H3