Vitas-M small molecule compound

N-(2,4,4-trimethylpentan-2-yl)-1,3-benzodioxole-5-carboxamide

Catalog ID
STK260412
SMILES O=C(c1ccc2c(c1)OCO2)NC(CC(C)(C)C)(C)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 C16H23NO3 MW 277.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO3/c1-15(2,3)9-16(4,5)17-14(18)11-6-7-12-13(8-11)20-10-19-12/h6-8H,9-10H2,1-5H3,(H,17,18)
InChIKey
OUVHVTFQGIVZFM-UHFFFAOYSA-N
Synonyms
895861-63-9
895861639
CC(C)(C)CC(C)(C)NC(=O)C1=CC2=C(C=C1)OCO2
InChI=1SC16H23NO3c115(23)916(45)1714(18)11671213(811)20101912h68H910H215H3(H1718)
MFCD06152309
N(244trimethylpentan2yl)13benzodioxole5carboxamide
ZINC000009426416
ZINC09426416
ZINC9426416

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Available files

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