Vitas-M small molecule compound
1-(1H-benzimidazol-1-yl)-2-(3-methyl-4-nitrophenoxy)ethanone
Catalog ID
STK767314
SMILES [O-][N+](=O)c1ccc(cc1C)OCC(=O)n1cnc2c1cccc2
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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 C16H13N3O4 MW 311.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4/c1-11-8-12(6-7-14(11)19(21)22)23-9-16(20)18-10-17-13-4-2-3-5-15(13)18/h2-8,10H,9H2,1H3InChIKey
GFCXYUGMIFILKA-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1C)OCC(=O)n1cnc2c1cccc2
1(1Hbenzimidazol1yl)2(3methyl4nitrophenoxy)ethanone
1(BENZIMIDAZOL1YL)2(3METHYL4NITROPHENOXY)ETHANONE
1BENZIMIDAZOLYL2(3METHYL4NITROPHENOXY)ETHAN1ONE
CC1=C(C=CC(=C1)OCC(=O)N2C=NC3=CC=CC=C32)(N+)(=O)(O)
InChI=1SC16H13N3O4c111812(6714(11)19(21)22)23916(20)18101713423515(13)18h2810H9H21H3
MFCD03015925
ZINC000000036333
ZINC00036333
ZINC36333
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