Vitas-M small molecule compound
N-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl}-3-nitrobenzamide
Catalog ID
STK836326
SMILES O=C(c1cccc(c1)[N+](=O)[O-])NCC1(CCCC1)c1ccc2c(c1)OCCO2
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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c24-20(15-4-3-5-17(12-15)23(25)26)22-14-21(8-1-2-9-21)16-6-7-18-19(13-16)28-11-10-27-18/h3-7,12-13H,1-2,8-11,14H2,(H,22,24)InChIKey
GBNPQOFDPICNCA-UHFFFAOYSA-NSynonyms
C1CCC(C1)(CNC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC4=C(C=C3)OCCO4
InChI=1SC21H22N2O5c2420(1543517(1215)23(25)26)221421(812921)16671819(1316)2811102718h371213H1281114H2(H2224)
MFCD00698988
N((1(23dihydro14benzodioxin6yl)cyclopentyl)methyl)3nitrobenzamide
N((1(23dihydrobenzo(b)(14)dioxin6yl)cyclopentyl)methyl)3nitrobenzamide
N((2H3HBENZO(34E)14DIOXIN6YLCYCLOPENTYL)METHYL)(3NITROPHENYL)CARBOXAMIDE
N(1(23DIHYDROBENZO(14)DIOXIN6YL)CYCLOPENTYLMETHYL)3NITROBENZAMIDE
O=C(c1cccc(c1)(N+)(=O)(O))NCC1(CCCC1)c1ccc2c(c1)OCCO2
ZINC000000895270
ZINC00895270
ZINC895270
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