Vitas-M small molecule compound

ethyl 3-amino-1-(4-hydroxy-3-methoxyphenyl)-1H-benzo[f]chromene-2-carboxylate

Catalog ID
STK529103
SMILES CCOC(=O)C1=C(N)Oc2c(C1c1ccc(c(c1)OC)O)c1ccccc1cc2

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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 C23H21NO5 MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO5/c1-3-28-23(26)21-19(14-8-10-16(25)18(12-14)27-2)20-15-7-5-4-6-13(15)9-11-17(20)29-22(21)24/h4-12,19,25H,3,24H2,1-2H3
InChIKey
NPWPBZTVFJKHEC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC2=C(C1C3=CC(=C(C=C3)O)OC)C4=CC=CC=C4C=C2)N
ethyl3amino1(4hydroxy3methoxyphenyl)1Hbenzo(f)chromene2carboxylate
InChI=1SC23H21NO5c132823(26)2119(1481016(25)18(1214)272)2015754613(15)91117(20)2922(21)24h4121925H324H212H3
MFCD01959795
ZINC000002289264
ZINC000002289265

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Available files

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