Vitas-M small molecule compound
3-(2-methoxy-5-nitrobenzyl)-1,3-benzoxazol-2(3H)-one
Catalog ID
STK665490
SMILES COc1ccc(cc1Cn1c(=O)oc2c1cccc2)[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 C15H12N2O5 MW 300.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O5/c1-21-13-7-6-11(17(19)20)8-10(13)9-16-12-4-2-3-5-14(12)22-15(16)18/h2-8H,9H2,1H3InChIKey
UMBNQQNZZGWRBF-UHFFFAOYSA-NSynonyms
3((2methoxy5nitrophenyl)methyl)13benzoxazol2one
3((2METHOXY5NITROPHENYL)METHYL)3HYDROBENZOXAZOL2ONE
3(2methoxy5nitrobenzyl)13benzoxazol2(3H)one
COC1=C(C=C(C=C1)(N+)(=O)(O))CN2C3=CC=CC=C3OC2=O
COc1ccc(cc1Cn1c(=O)oc2c1cccc2)(N+)(=O)(O)
InChI=1SC15H12N2O5c121137611(17(19)20)810(13)91612423514(12)2215(16)18h28H9H21H3
MFCD09064662
ZINC000012371121
ZINC12371121
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