Vitas-M small molecule compound

4-[(4-methoxybenzyl)amino]-1-oxaspiro[4.5]dec-3-en-2-one

Catalog ID
STK758437
SMILES COc1ccc(cc1)CNC1=CC(=O)OC21CCCCC2

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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 C17H21NO3 MW 287.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3/c1-20-14-7-5-13(6-8-14)12-18-15-11-16(19)21-17(15)9-3-2-4-10-17/h5-8,11,18H,2-4,9-10,12H2,1H3
InChIKey
YSMBYYTVQXQODQ-UHFFFAOYSA-N
Synonyms
5857-40-9
1((4METHOXYPHENYL)METHYLAMINO)4OXASPIRO(45)DEC1EN3ONE
4((4methoxybenzyl)amino)1oxaspiro(45)dec3en2one
4((4methoxyphenyl)methylamino)1oxaspiro(45)dec3en2one
4(4METHOXYBENZYLAMINO)1OXASPIRO(45)DEC3EN2ONE
5857409
COC1=CC=C(C=C1)CNC2=CC(=O)OC23CCCCC3
InChI=1SC17H21NO3c120147513(6814)1218151116(19)2117(15)93241017h581118H2491012H21H3
MFCD01414702
ZINC000000052037
ZINC00052037
ZINC52037

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Available files

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