Vitas-M small molecule compound
(2Z)-2-(hydroxyimino)-2-phenylethyl 2-{[(4-nitrophenyl)carbonyl]amino}benzoate
Catalog ID
STK285401
SMILES O/N=C(/c1ccccc1)\COC(=O)c1ccccc1NC(=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 C22H17N3O6 MW 419.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O6/c26-21(16-10-12-17(13-11-16)25(29)30)23-19-9-5-4-8-18(19)22(27)31-14-20(24-28)15-6-2-1-3-7-15/h1-13,28H,14H2,(H,23,26)/b24-20+InChIKey
JEWFHYKKZYTMPZ-HIXSDJFHSA-NSynonyms
((2Z)2hydroxyimino2phenylethyl)2((4nitrobenzoyl)amino)benzoate
(2Z)2(hydroxyimino)2phenylethyl2(((4nitrophenyl)carbonyl)amino)benzoate
C1=CC=C(C=C1)C(=NO)COC(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC22H17N3O6c2621(16101217(131116)25(29)30)2319954818(19)22(27)311420(2428)156213715h11328H14H2(H2326)b2420+
MFCD00859583
ON=C(c1ccccc1)COC(=O)c1ccccc1NC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000102519907
ZINC9261835
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