Vitas-M small molecule compound

methyl (4Z)-4-(3-methoxybenzylidene)-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK165339
SMILES COCCCN1C(=C(/C(=C/c2cccc(c2)OC)/C1=O)C(=O)OC)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 C19H23NO5 MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO5/c1-13-17(19(22)25-4)16(18(21)20(13)9-6-10-23-2)12-14-7-5-8-15(11-14)24-3/h5,7-8,11-12H,6,9-10H2,1-4H3/b16-12-
InChIKey
FMVVQPDAKRYOSS-VBKFSLOCSA-N
Synonyms

CC1=C(C(=CC2=CC(=CC=C2)OC)C(=O)N1CCCOC)C(=O)OC
COCCCN1C(=C(C(=Cc2cccc(c2)OC)C1=O)C(=O)OC)C
InChI=1SC19H23NO5c11317(19(22)254)16(18(21)20(13)9610232)121475815(1114)243h5781112H6910H214H3b1612
METHYL(4Z)4((3METHOXYPHENYL)METHYLIDENE)1(3METHOXYPROPYL)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)4(3METHOXYBENZYLIDENE)1(3METHOXYPROPYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03016538
ZINC000004169919
ZINC04169919
ZINC4169919

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Available files

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