Vitas-M small molecule compound
4-[(Z)-(2-{[4-(butan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]-2-methoxyphenyl 4-nitrobenzoate
Catalog ID
STK217050
SMILES CCC(c1ccc(cc1)OCC(=O)N/N=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)[N+](=O)[O-])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 C27H27N3O7 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O7/c1-4-18(2)20-8-12-23(13-9-20)36-17-26(31)29-28-16-19-5-14-24(25(15-19)35-3)37-27(32)21-6-10-22(11-7-21)30(33)34/h5-16,18H,4,17H2,1-3H3,(H,29,31)/b28-16-InChIKey
IVQURNASRSHHIS-NTFVMDSBSA-NSynonyms
(4((Z)((2(4butan2ylphenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl)4nitrobenzoate
4((Z)(2((4(butan2yl)phenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl4nitrobenzoate
CCC(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC
CCC(c1ccc(cc1)OCC(=O)NN=Cc1ccc(c(c1)OC)OC(=O)c1ccc(cc1)(N+)(=O)(O))C
InChI=1SC27H27N3O7c1418(2)2081223(13920)361726(31)2928161951424(25(1519)353)3727(32)2161022(11721)30(33)34h51618H417H213H3(H2931)b2816
MFCD08681089
ZINC000030822046
ZINC000030822047
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