Vitas-M small molecule compound

dimethyl {3-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}propanedioate

Catalog ID
STL506569
SMILES CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])C=C(C(=O)OC)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 C21H21NO8 MW 415.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO8/c1-4-29-19-12-15(11-17(20(23)27-2)21(24)28-3)7-10-18(19)30-13-14-5-8-16(9-6-14)22(25)26/h5-12H,4,13H2,1-3H3
InChIKey
IWVFRBHGXHODKT-UHFFFAOYSA-N
Synonyms

1274512
2((3ETHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)PROPANEDIOICACIDDIMETHYLESTER
2(3ETHOXY4(4NITROBENZYL)OXYBENZYLIDENE)MALONICACIDDIMETHYLESTER
DIMETHYL(3ETHOXY4((4NITROBENZYL)OXY)BENZYLIDENE)MALONATE
dimethyl(3ethoxy4((4nitrobenzyl)oxy)benzylidene)propanedioate
DIMETHYL2((3ETHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)PROPANEDIOATE
InChI=1SC21H21NO8c1429191215(1117(20(23)272)21(24)283)71018(19)3013145816(9614)22(25)26h512H413H213H3
MFCD02209340
ZINC000001090581
ZINC1090581

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Available files

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