Vitas-M small molecule compound

methyl 2-amino-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STK870619
SMILES COc1ccc(cc1)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C(=O)OC

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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 C20H23NO5 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO5/c1-20(2)9-13(22)16-14(10-20)26-18(21)17(19(23)25-4)15(16)11-5-7-12(24-3)8-6-11/h5-8,15H,9-10,21H2,1-4H3
InChIKey
CYIVTFANSFLSMR-UHFFFAOYSA-N
Synonyms
303980-23-6
303980236
CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=C(C=C3)OC)C(=O)C1)C
InChI=1SC20H23NO5c120(2)913(22)1614(1020)2618(21)17(19(23)254)15(16)115712(243)8611h5815H91021H214H3
METHYL2AMINO4(4METHOXYPHENYL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBOXYLATE
methyl2amino4(4methoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
METHYL2AMINO4(4METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
MFCD00715996
ZINC000000841931
ZINC000003073413

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Available files

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