Название: compound 22

IUPAC: 1-(2-hydroxy-5-methoxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione

SMILES: COc1ccc(O)c(C(=O)CC(=O)c2ccc([N+](=O)[O-])cc2)c1

Canonical SMILES: COC1=CC(=C(C=C1)O)C(=O)CC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Молекулярная формула: C16H13NO6

Молекулярная масса: 315.28

InChIKey: BXTPVVWTAGMTNH-UHFFFAOYSA-N

InChI: InChI=1S/C16H13NO6/c1-23-12-6-7-14(18)13(8-12)16(20)9-15(19)10-2-4-11(5-3-10)17(21)22/h2-8,18H,9H2,1H3

Синонимы

SCHEMBL4992719BXTPVVWTAGMTNH-UHFFFAOYSA-N1-(5-methoxy-2-hydroxyphenyl)-3-(4-nitrophenyl)propan-1,3-dione