化学式

CAS号

IUPAC Name

(3R,4R)-2-(3-溴苯基)-3-(2,3-二氢-1,4-苯并二噁英-6-基)-1-氧代-3,4-二氢异喹啉-4-羧酸 (3R,4R)-2-(3-bromophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid

InChI

InChI=1S/C24H18BrNO5/c25-15-4-3-5-16(13-15)26-22(14-8-9-19-20(12-14)31-11-10-30-19)21(24(28)29)17-6-1-2-7-18(17)23(26)27/h1-9,12-13,21-22H,10-11H2,(H,28,29)/t21-,22+/m1/s1

InChI Key

LLNOZAQULAKFNZ-YADHBBJMSA-N

Canonical SMILES

C1COC2=C(O1)C=CC(=C2)C3C(C4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)Br)C(=O)O

别名

• SCHEMBL21383489