Vitas-M small molecule compound
N-[3-(1,3-benzodioxol-5-yl)-6-chloro-4-oxo-4H-chromen-2-yl]-4-nitrobenzamide
Catalog ID
STK714788
SMILES Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1ccc(cc1)[N+](=O)[O-])c1ccc2c(c1)OCO2
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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 C23H13ClN2O7 MW 464.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O7/c24-14-4-8-17-16(10-14)21(27)20(13-3-7-18-19(9-13)32-11-31-18)23(33-17)25-22(28)12-1-5-15(6-2-12)26(29)30/h1-10H,11H2,(H,25,28)InChIKey
ZQMCBXHHTJVJOV-UHFFFAOYSA-NSynonyms
879449-52-2879449522
C1OC2=C(O1)C=C(C=C2)C3=C(OC4=C(C3=O)C=C(C=C4)Cl)NC(=O)C5=CC=C(C=C5)(N+)(=O)(O)
Clc1ccc2c(c1)c(=O)c(c(o2)NC(=O)c1ccc(cc1)(N+)(=O)(O))c1ccc2c(c1)OCO2
InChI=1SC23H13ClN2O7c2414481716(1014)21(27)20(13371819(913)32113118)23(3317)2522(28)121515(6212)26(29)30h110H11H2(H2528)
MFCD06776396
N(3(13benzodioxol5yl)6chloro4oxo4Hchromen2yl)4nitrobenzamide
N(3(13BENZODIOXOL5YL)6CHLORO4OXOCHROMEN2YL)4NITROBENZAMIDE
N(3(benzo(d)(13)dioxol5yl)6chloro4oxo4Hchromen2yl)4nitrobenzamide
ZINC000101330810
ZINC101330810
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