Vitas-M small molecule compound

prop-2-yn-1-yl 2-(octylcarbamoyl)benzoate

Catalog ID
STK524177
SMILES CCCCCCCCNC(=O)c1ccccc1C(=O)OCC#C

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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 C19H25NO3 MW 315.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25NO3/c1-3-5-6-7-8-11-14-20-18(21)16-12-9-10-13-17(16)19(22)23-15-4-2/h2,9-10,12-13H,3,5-8,11,14-15H2,1H3,(H,20,21)
InChIKey
MQTUWOFPAHLUFF-UHFFFAOYSA-N
Synonyms

2PROPYNYL2((OCTYLAMINO)CARBONYL)BENZOATE
CCCCCCCCNC(=O)C1=CC=CC=C1C(=O)OCC#C
InChI=1SC19H25NO3c13567811142018(21)16129101317(16)19(22)231542h29101213H358111415H21H3(H2021)
MFCD00543100
O2PROPYNYLNNOCTYLPHTHALAMATE
PROP2YN1YL2(OCTYLCARBAMOYL)BENZOATE
PROP2YNYL2(NOCTYLCARBAMOYL)BENZOATE
PROP2YNYL2(OCTYLCARBAMOYL)BENZOATE
ZINC000003127772
ZINC3127772

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Available files

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