Vitas-M small molecule compound
9-{3-chloro-4-[(4-nitrobenzyl)oxy]phenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Catalog ID
STK393932
SMILES O=C1CCCC2=C1C(c1ccc(c(c1)Cl)OCc1ccc(cc1)[N+](=O)[O-])C1=C(N2)CCCC1=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 C26H23ClN2O5 MW 478.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O5/c27-18-13-16(9-12-23(18)34-14-15-7-10-17(11-8-15)29(32)33)24-25-19(3-1-5-21(25)30)28-20-4-2-6-22(31)26(20)24/h7-13,24,28H,1-6,14H2InChIKey
VJXDHDKSLUFWLY-UHFFFAOYSA-NSynonyms
9(3chloro4((4nitrobenzyl)oxy)phenyl)3467910hexahydroacridine18(2H5H)dione
9(3chloro4((4nitrophenyl)methoxy)phenyl)234567910octahydroacridine18dione
C1CC2=C(C(C3=C(N2)CCCC3=O)C4=CC(=C(C=C4)OCC5=CC=C(C=C5)(N+)(=O)(O))Cl)C(=O)C1
InChI=1SC26H23ClN2O5c27181316(91223(18)34141571017(11815)29(32)33)242519(31521(25)30)282042622(31)26(20)24h7132428H1614H2
MFCD03649652
O=C1CCCC2=C1C(c1ccc(c(c1)Cl)OCc1ccc(cc1)(N+)(=O)(O))C1=C(N2)CCCC1=O
ZINC000020109990
ZINC20109990
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