Vitas-M small molecule compound
4-oxo-3-phenyl-4H-chromen-7-yl 3-nitrobenzoate
Catalog ID
STK853135
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc2c(c1)occ(c2=O)c1ccccc1
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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 C22H13NO6 MW 387.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13NO6/c24-21-18-10-9-17(29-22(25)15-7-4-8-16(11-15)23(26)27)12-20(18)28-13-19(21)14-5-2-1-3-6-14/h1-13HInChIKey
BDDUQQZNAVPABT-UHFFFAOYSA-NSynonyms
618391-22-3(4OXO3PHENYLCHROMEN7YL)3NITROBENZOATE
4oxo3phenyl4Hchromen7yl3nitrobenzoate
4OXO3PHENYLCHROMEN7YL3NITROBENZOATE
618391223
C1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H13NO6c24211810917(2922(25)1574816(1115)23(26)27)1220(18)281319(21)145213614h113H
MFCD04165185
O=C(c1cccc(c1)(N+)(=O)(O))Oc1ccc2c(c1)occ(c2=O)c1ccccc1
ZINC000001447961
ZINC01447961
ZINC1447961
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