이름: compound 3
IUPAC: 1-(5-bromo-2-hydroxyphenyl)-3-(4-nitrophenyl)propane-1,3-dione
SMILES:
O=C(CC(=O)c1cc(Br)ccc1O)c1ccc([N+](=O)[O-])cc1Canonical SMILES:
C1=CC(=CC=C1C(=O)CC(=O)C2=C(C=CC(=C2)Br)O)[N+](=O)[O-]분자식: C15H10BrNO5
분자량: 364.15
InChIKey: DBKXABJVUMQFRN-UHFFFAOYSA-N
InChI:
PubChem CID: 11523417 →InChI=1S/C15H10BrNO5/c16-10-3-6-13(18)12(7-10)15(20)8-14(19)9-1-4-11(5-2-9)17(21)22/h1-7,18H,8H2동의어
SCHEMBL4985512DBKXABJVUMQFRN-UHFFFAOYSA-N1-(5-bromo-2-hydroxyphenyl)-3-(4-nitrophenyl)propan-1,3-dione