Vitas-M small molecule compound
2-chloro-5-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)benzoic acid
Catalog ID
STK281005
SMILES O=C1N(c2ccc(c(c2)C(=O)O)Cl)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 C17H14ClNO4 MW 331.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClNO4/c18-12-6-5-10(7-11(12)17(22)23)19-15(20)13-8-1-2-9(4-3-8)14(13)16(19)21/h1-2,5-9,13-14H,3-4H2,(H,22,23)InChIKey
IYDXRYYGRNQATP-UHFFFAOYSA-NSynonyms
2chloro5(13dioxo133a477ahexahydro2H47ethanoisoindol2yl)benzoicacid
C1CC2C=CC1C3C2C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)C(=O)O
InChI=1SC17H14ClNO4c18126510(711(12)17(22)23)1915(20)138129(438)14(13)16(19)21h12591314H34H2(H2223)
MFCD01240521
ZINC000100058537
ZINC000101360044
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