Vitas-M small molecule compound
(4Z)-3-methyl-4-({[(2-methyl-1,3-benzoxazol-7-yl)carbonyl]oxy}imino)cyclohexa-2,5-dien-1-one
Catalog ID
STK772707
SMILES O=C1C=C/C(=N/OC(=O)c2cccc3c2oc(n3)C)/C(=C1)C
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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 C16H12N2O4 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4/c1-9-8-11(19)6-7-13(9)18-22-16(20)12-4-3-5-14-15(12)21-10(2)17-14/h3-8H,1-2H3/b18-13-InChIKey
KUSKYXKKTSTTEO-AQTBWJFISA-NSynonyms
((Z)(2METHYL4OXOCYCLOHEXA25DIEN1YLIDENE)AMINO)2METHYL13BENZOXAZOLE7CARBOXYLATE
(1Z)2METHYLBENZO14QUINONE1(O((2METHYL13BENZOXAZOL7YL)CARBONYL)OXIME)
(4Z)3methyl4((((2methyl13benzoxazol7yl)carbonyl)oxy)imino)cyclohexa25dien1one
25CYCLOHEXADIEN1ONE3METHYL4((((2METHYL13BENZOXAZOL7YL)CARBONYL)OXY)IMINO)
CC1=CC(=O)C=CC1=NOC(=O)C2=C3C(=CC=C2)N=C(O3)C
InChI=1SC16H12N2O4c19811(19)6713(9)182216(20)124351415(12)2110(2)1714h38H12H3b1813
MFCD03820632
O=C1C=CC(=NOC(=O)c2cccc3c2oc(n3)C)C(=C1)C
ZINC000001078144
ZINC108450
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