Vitas-M small molecule compound
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 4-[(3,4-dichlorophenyl)amino]-4-oxobutanoate
Catalog ID
STK269487
SMILES O=C(OCC(=O)c1ccc(c(c1)[N+](=O)[O-])C)CCC(=O)Nc1ccc(c(c1)Cl)Cl
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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 C19H16Cl2N2O6 MW 439.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl2N2O6/c1-11-2-3-12(8-16(11)23(27)28)17(24)10-29-19(26)7-6-18(25)22-13-4-5-14(20)15(21)9-13/h2-5,8-9H,6-7,10H2,1H3,(H,22,25)InChIKey
ALLCSNBJHHIGKA-UHFFFAOYSA-NSynonyms
(2(4METHYL3NITROPHENYL)2OXOETHYL)4(34DICHLOROANILINO)4OXOBUTANOATE
2(4METHYL3NITROPHENYL)2OXOETHYL3(N(34DICHLOROPHENYL)CARBAMOYL)PROPANOATE
2(4methyl3nitrophenyl)2oxoethyl4((34dichlorophenyl)amino)4oxobutanoate
CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC(=C(C=C2)Cl)Cl)(N+)(=O)(O)
InChI=1SC19H16Cl2N2O6c1112312(816(11)23(27)28)17(24)102919(26)7618(25)22134514(20)15(21)913h2589H6710H21H3(H2225)
MFCD02314532
O=C(OCC(=O)c1ccc(c(c1)(N+)(=O)(O))C)CCC(=O)Nc1ccc(c(c1)Cl)Cl
ZINC000002983921
ZINC02983921
ZINC2983921
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