Vitas-M small molecule compound
4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
Catalog ID
STK274554
SMILES OC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=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 C16H13NO4 MW 283.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO4/c18-14-12-9-1-2-10(7-9)13(12)15(19)17(14)11-5-3-8(4-6-11)16(20)21/h1-6,9-10,12-13H,7H2,(H,20,21)InChIKey
NIGPPPVPMJYXFY-UHFFFAOYSA-NSynonyms
55099-10-04((3aR4R7S7aS)13dioxo3a477atetrahydro1H47methanoisoindol2(3H)yl)benzoicacid
4(133A477AHEXAHYDRO13DIOXO47METHANO2HISOINDOL2YL)BENZOICACID
4(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)BENZOICACID
4(13DIOXO3A477ATETRAHYDRO1H47METHANOISOINDOL2(3H)YL)BENZOICACID
4(3A477ATETRAHYDRO13DIOXO47METHANOISOINDOLINE2YL)BENZOICACID
55099100
BENZOICACID4(233A477AHEXAHYDRO47METHANO13DIOXO2ISOINDOLYL)
C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)C(=O)O
InChI=1SC16H13NO4c18141291210(79)13(12)15(19)17(14)11538(4611)16(20)21h169101213H7H2(H2021)
MFCD00415604
ZINC000100147476
ZINC000100824706
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