Vitas-M small molecule compound
2-(4-methylphenyl)-2-oxoethyl 4-nitrobenzoate
Catalog ID
STK204860
SMILES Cc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)[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 C16H13NO5 MW 299.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO5/c1-11-2-4-12(5-3-11)15(18)10-22-16(19)13-6-8-14(9-7-13)17(20)21/h2-9H,10H2,1H3InChIKey
QYJNVDALAPKSCI-UHFFFAOYSA-NSynonyms
324066-05-9(2(4METHYLPHENYL)2OXOETHYL)4NITROBENZOATE
2(4METHYLPHENYL)2OXOETHYL4NITROBENZOATE
324066059
CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
Cc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC16H13NO5c1112412(5311)15(18)102216(19)136814(9713)17(20)21h29H10H21H3
MFCD01627756
ZINC000004740699
ZINC04740699
ZINC4740699
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