Vitas-M small molecule compound

propyl 4-{[(6-bromo-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-yl)carbonyl]amino}benzoate

Catalog ID
STK265925
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)C1C2CC3C1C(=O)OC3C2Br

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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 C19H20BrNO5 MW 422.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO5/c1-2-7-25-18(23)9-3-5-10(6-4-9)21-17(22)13-11-8-12-14(13)19(24)26-16(12)15(11)20/h3-6,11-16H,2,7-8H2,1H3,(H,21,22)
InChIKey
AXHFZTHOZFICSC-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2C3CC4C2C(=O)OC4C3Br
InChI=1SC19H20BrNO5c1272518(23)93510(649)2117(22)131181214(13)19(24)2616(12)15(11)20h361116H278H21H3(H2122)
MFCD08097511
propyl4(((6bromo2oxohexahydro2H35methanocyclopenta(b)furan7yl)carbonyl)amino)benzoate
ZINC000101879472
ZINC000239009595

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.