Vitas-M small molecule compound
2-(3-nitrophenyl)-2-oxoethyl 3-bromo-4-methylbenzoate
Catalog ID
STK388096
SMILES O=C(c1ccc(c(c1)Br)C)OCC(=O)c1cccc(c1)[N+](=O)[O-]
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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 C16H12BrNO5 MW 378.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrNO5/c1-10-5-6-12(8-14(10)17)16(20)23-9-15(19)11-3-2-4-13(7-11)18(21)22/h2-8H,9H2,1H3InChIKey
OUYYQYGWJXXKLX-UHFFFAOYSA-NSynonyms
355372-54-2(2(3NITROPHENYL)2OXOETHYL)3BROMO4METHYLBENZOATE
2(3NITROPHENYL)2OXOETHYL3BROMO4METHYLBENZOATE
355372542
CC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))Br
InChI=1SC16H12BrNO5c1105612(814(10)17)16(20)23915(19)1132413(711)18(21)22h28H9H21H3
MFCD01435529
O=C(c1ccc(c(c1)Br)C)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000001170871
ZINC01170871
ZINC1170871
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