Vitas-M small molecule compound
8-(benzyloxy)-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Catalog ID
STK784255
SMILES [O-][N+](=O)c1cc2Oc3cc(ccc3Cc3c2c(c1)[nH]c3)OCc1ccccc1
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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 C22H16N2O4 MW 372.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O4/c25-24(26)17-9-19-22-16(12-23-19)8-15-6-7-18(11-20(15)28-21(22)10-17)27-13-14-4-2-1-3-5-14/h1-7,9-12,23H,8,13H2InChIKey
LKYLXDJLYMTRIF-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc2Oc3cc(ccc3Cc3c2c(c1)(nH)c3)OCc1ccccc1
8(benzyloxy)4nitro211dihydro(1)benzoxepino(432cd)indole
C1C2=C(C=C(C=C2)OCC3=CC=CC=C3)OC4=C5C1=CNC5=CC(=C4)(N+)(=O)(O)
InChI=1SC22H16N2O4c2524(26)179192216(122319)8156718(1120(15)2821(22)1017)2713144213514h1791223H813H2
MFCD07021769
ZINC000004754150
ZINC04754150
ZINC4754150
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