Vitas-M small molecule compound
(2Z)-2-(2-methylbenzylidene)-3-oxo-7-(pyrrolidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK850326
SMILES O=C1/C(=C/c2ccccc2C)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C21H21NO3 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3/c1-14-6-2-3-7-15(14)12-19-20(24)16-8-9-18(23)17(21(16)25-19)13-22-10-4-5-11-22/h2-3,6-9,12,23H,4-5,10-11,13H2,1H3/b19-12-InChIKey
DETWRUFSCTUAGI-UNOMPAQXSA-NSynonyms
896837-46-0(2Z)2((2methylphenyl)methylidene)3oxo7(pyrrolidin1ium1ylmethyl)1benzofuran6olate
(2Z)2(2methylbenzylidene)3oxo7(pyrrolidinium1ylmethyl)23dihydro1benzofuran6olate
(2Z)6HYDROXY2((2METHYLPHENYL)METHYLIDENE)7(PYRROLIDIN1YLMETHYL)1BENZOFURAN3ONE
6HYDROXY2((2METHYLPHENYL)METHYLENE)7(PYRROLIDINYLMETHYL)BENZO(B)FURAN3ONE
896837460
CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C(=C(C=C3)(O))C(NH+)4CCCC4
InChI=1SC21H21NO3c114623715(14)121920(24)168918(23)17(21(16)2519)132210451122h23691223H45101113H21H3b1912
MFCD06600541
O=C1C(=Cc2ccccc2C)Oc2c1ccc(c2C(NH+)1CCCC1)(O)
ZINC000013816201
ZINC13816201
Check stock
See real-time availability and sample size for STK850326 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.