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

Systemtic Name: 2,2-dimethyl-7-[(4-nitrophenyl)methoxy]-5-oxidanyl-3H-chromen-4-one Openeye Name: 5-hydroxy-2,2-dimethyl-7-[(4-nitrophenyl)methoxy]chroman-4-one CAS Name: 5-hydroxy-2,2-dimethyl-7-[(4-nitrophenyl)methoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 5-hydroxy-2,2-dimethyl-7-[(4-nitrophenyl)methoxy]-3H-chromen-4-one Traditional Name: 5-hydroxy-2,2-dimethyl-7-(4-nitrobenzyl)oxy-chroman-4-one Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC3=CC=C(C=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC3=CC=C(C=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C18H17NO6/c1-18(2)9-15(21)17-14(20)7-13(8-16(17)25-18)24-10-11-3-5-12(6-4-11)19(22)23/h3-8,20H,9-10H2,1-2H3