Vitas-M small molecule compound
{5-[(4-nitrophenoxy)methyl]furan-2-yl}[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone
Catalog ID
STK302722
SMILES O=C(c1ccc(o1)COc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)C12CC3CC(C2)CC(C1)C3
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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 C26H31N3O5 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O5/c30-25(24-6-5-23(34-24)17-33-22-3-1-21(2-4-22)29(31)32)27-7-9-28(10-8-27)26-14-18-11-19(15-26)13-20(12-18)16-26/h1-6,18-20H,7-17H2InChIKey
AJUSRDDPUBVFNX-UHFFFAOYSA-NSynonyms
679419-47-7(4(1ADAMANTYL)PIPERAZIN1YL)(5((4NITROPHENOXY)METHYL)FURAN2YL)METHANONE
(5((4nitrophenoxy)methyl)furan2yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
679419477
C1CN(CCN1C(=O)C2=CC=C(O2)COC3=CC=C(C=C3)(N+)(=O)(O))C45CC6CC(C4)CC(C6)C5
InChI=1SC26H31N3O5c3025(246523(3424)1733223121(2422)29(31)32)277928(10827)2614181119(1526)1320(1218)1626h161820H717H2
MFCD04048185
O=C(c1ccc(o1)COc1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)C12CC3CC(C2)CC(C1)C3
ZINC000008455654
ZINC8455654
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