Vitas-M small molecule compound
(3aR,7aS)-2-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK311421
SMILES Cc1cc(Oc2cc(cc(c2)N2C(=O)[C@@H]3[C@H](C2=O)CCCC3)[N+](=O)[O-])c(c(c1)C)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 C23H24N2O5 MW 408.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O5/c1-13-8-14(2)15(3)21(9-13)30-18-11-16(10-17(12-18)25(28)29)24-22(26)19-6-4-5-7-20(19)23(24)27/h8-12,19-20H,4-7H2,1-3H3/t19-,20+InChIKey
SZUJPTXHVPFNHB-BGYRXZFFSA-NSynonyms
1052591-81-7(3aR7aS)2(3nitro5(235trimethylphenoxy)phenyl)hexahydro1Hisoindole13(2H)dione
(3aS7aR)2(3nitro5(235trimethylphenoxy)phenyl)3a45677ahexahydroisoindole13dione
1052591817
CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))N3C(=O)C4CCCCC4C3=O)C)C
Cc1cc(Oc2cc(cc(c2)N2C(=O)(C@@H)3(C@H)(C2=O)CCCC3)(N+)(=O)(O))c(c(c1)C)C
InChI=1SC23H24N2O5c113814(2)15(3)21(913)30181116(1017(1218)25(28)29)2422(26)19645720(19)23(24)27h8121920H47H213H3t1920+
MFCD04137848
ZINC000006921966
ZINC06921966
ZINC6921966
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