Vitas-M small molecule compound

2-{[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene}-1H-indene-1,3(2H)-dione

Catalog ID
STK699539
SMILES [O-][N+](=O)c1cc(ccc1Cl)c1ccc(o1)/C=C/1\C(=O)c2c(C1=O)cccc2

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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 C20H10ClNO5 MW 379.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H10ClNO5/c21-16-7-5-11(9-17(16)22(25)26)18-8-6-12(27-18)10-15-19(23)13-3-1-2-4-14(13)20(15)24/h1-10H
InChIKey
JGGUWKYREGMRRQ-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1C(=O)c2c(C1=O)cccc2
2((5(4chloro3nitrophenyl)furan2yl)methylidene)1Hindene13(2H)dione
2((5(4CHLORO3NITROPHENYL)FURAN2YL)METHYLIDENE)INDENE13DIONE
2(5(4CHLORO3NITROPHENYL)FURAN2YLMETHYLENE)INDAN13DIONE
C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C2=O
InChI=1SC20H10ClNO5c21167511(917(16)22(25)26)188612(2718)101519(23)13312414(13)20(15)24h110H
MFCD00741732
ZINC000001051300
ZINC01051300
ZINC1051300

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Available files

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