Vitas-M small molecule compound
(3Z)-7-nitro-3-(2-oxo-2-phenylethylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STK762476
SMILES O=C(c1ccccc1)/C=c/1\[nH]c2ccc(cc2oc1=O)[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 C16H10N2O5 MW 310.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O5/c19-14(10-4-2-1-3-5-10)9-13-16(20)23-15-8-11(18(21)22)6-7-12(15)17-13/h1-9,17H/b13-9-InChIKey
KVWMEQMRMSFRBD-LCYFTJDESA-NSynonyms
299918-87-9(3Z)7nitro3(2oxo2phenylethylidene)34dihydro2H14benzoxazin2one
(3Z)7NITRO3PHENACYLIDENE4H14BENZOXAZIN2ONE
(E)7nitro3(2oxo2phenylethylidene)34dihydro2Hbenzo(b)(14)oxazin2one
299918879
4HBENZ(B)14OXAZIN2(3H)ONE7NITRO3(2OXO2PHENYLETHYLIDENO)
7NITRO3(2OXO2PHENYLETHYLIDENE)34DIHYDRO2H14BENZOXAZIN2ONE
C1=CC=C(C=C1)C(=O)C=C2C(=O)OC3=C(N2)C=CC(=C3)(N+)(=O)(O)
InChI=1SC16H10N2O5c1914(104213510)91316(20)2315811(18(21)22)6712(15)1713h1917Hb139
MFCD01871909
O=C(c1ccccc1)C=c1(nH)c2ccc(cc2oc1=O)(N+)(=O)(O)
ZINC000100089015
ZINC100089015
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