Vitas-M small molecule compound

2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid

Catalog ID
STK359615
SMILES O=C1C2C3C=CC(C2C(=O)N1c1ccccc1C(=O)O)C3

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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 C16H13NO4 MW 283.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO4/c18-14-12-8-5-6-9(7-8)13(12)15(19)17(14)11-4-2-1-3-10(11)16(20)21/h1-6,8-9,12-13H,7H2,(H,20,21)
InChIKey
HYVCRTFVNMBICJ-UHFFFAOYSA-N
Synonyms
298682-50-5
2(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)BENZOICACID
2(13DIOXO3A477ATETRAHYDRO1H47METHANOISOINDOL2(3H)YL)BENZOICACID
298682505
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=CC=C4C(=O)O
InChI=1SC16H13NO4c1814128569(78)13(12)15(19)17(14)11421310(11)16(20)21h16891213H7H2(H2021)
MFCD00415603
ZINC000100149552
ZINC000238900204

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Available files

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