Vitas-M small molecule compound
3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)benzoic acid
Catalog ID
STK281004
SMILES O=C1N(c2cccc(c2)C(=O)O)C(=O)C2C1C1CCC2C=C1
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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 C17H15NO4 MW 297.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO4/c19-15-13-9-4-5-10(7-6-9)14(13)16(20)18(15)12-3-1-2-11(8-12)17(21)22/h1-5,8-10,13-14H,6-7H2,(H,21,22)InChIKey
BMDLTEZWROCHSR-UHFFFAOYSA-NSynonyms
3(13dioxo133a477ahexahydro2H47ethanoisoindol2yl)benzoicacid
C1CC2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O
InChI=1SC17H15NO4c19151394510(769)14(13)16(20)18(15)1231211(812)17(21)22h158101314H67H2(H2122)
MFCD00750663
ZINC000100186209
ZINC000101115645
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