Vitas-M small molecule compound
2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-3-phenylpropanoic acid
Catalog ID
STK005853
SMILES O=c1n(C(C(=O)O)Cc2ccccc2)c(=O)c2c3c1cccc3ccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H15NO4 MW 345.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO4/c23-19-15-10-4-8-14-9-5-11-16(18(14)15)20(24)22(19)17(21(25)26)12-13-6-2-1-3-7-13/h1-11,17H,12H2,(H,25,26)InChIKey
SJGFGXSJCPZIMK-UHFFFAOYSA-NSynonyms
2(13DIOXO1H3HBENZO(DE)ISOQUINOLIN2YL)3PHENYLPROPIONICACID
2(13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)3PHENYLPROPANOICACID
2(13DIOXOBENZO(DE)ISOQUINOLIN2YL)3PHENYLPROPANOICACID
C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
InChI=1SC21H15NO4c231915104814951116(18(14)15)20(24)22(19)17(21(25)26)12136213713h11117H12H2(H2526)
MFCD00696748
O=c1n(C(C(=O)O)Cc2ccccc2)c(=O)c2c3c1cccc3ccc2
STK005853
ZINC000003900907
ZINC000003900908
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