Vitas-M small molecule compound

3-(4-chlorophenyl)-7-[(4-nitrobenzyl)oxy]-4H-chromen-4-one

Catalog ID
STK888722
SMILES Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1)[N+](=O)[O-]

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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 C22H14ClNO5 MW 407.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14ClNO5/c23-16-5-3-15(4-6-16)20-13-29-21-11-18(9-10-19(21)22(20)25)28-12-14-1-7-17(8-2-14)24(26)27/h1-11,13H,12H2
InChIKey
NNSXPHBWDVYHDO-UHFFFAOYSA-N
Synonyms
618389-61-0
3(4chlorophenyl)7((4nitrobenzyl)oxy)4Hchromen4one
3(4CHLOROPHENYL)7((4NITROPHENYL)METHOXY)CHROMEN4ONE
618389610
C1=CC(=CC=C1COC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)Cl)(N+)(=O)(O)
Clc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H14ClNO5c23165315(4616)201329211118(91019(21)22(20)25)2812141717(8214)24(26)27h11113H12H2
MFCD04165166
ZINC000001940987
ZINC01940987
ZINC1940987

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Available files

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