Vitas-M small molecule compound

N-(6-nitro-2-phenyl-1-benzofuran-4-yl)-1,3-benzodioxole-5-carboxamide

Catalog ID
STK767690
SMILES [O-][N+](=O)c1cc(NC(=O)c2ccc3c(c2)OCO3)c2c(c1)oc(c2)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 C22H14N2O6 MW 402.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O6/c25-22(14-6-7-18-21(8-14)29-12-28-18)23-17-9-15(24(26)27)10-20-16(17)11-19(30-20)13-4-2-1-3-5-13/h1-11H,12H2,(H,23,25)
InChIKey
GEIYUQTYQUFORQ-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc(NC(=O)c2ccc3c(c2)OCO3)c2c(c1)oc(c2)c1ccccc1
2HBENZO(34D)13DIOXOLAN5YLN(6NITRO2PHENYLBENZO(B)FURAN4YL)CARBOXAMIDE
C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC4=C3C=C(O4)C5=CC=CC=C5)(N+)(=O)(O)
InChI=1SC22H14N2O6c2522(14671821(814)29122818)2317915(24(26)27)102016(17)1119(3020)134213513h111H12H2(H2325)
MFCD03034933
N(6nitro2phenyl1benzofuran4yl)13benzodioxole5carboxamide
ZINC000001089598
ZINC01089598
ZINC1089598

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Available files

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