Vitas-M small molecule compound
2-(2-butoxyphenyl)-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK767525
SMILES CCCCOc1ccccc1N1C(=O)c2c(C1=O)cc(cc2)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 C28H31NO3 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO3/c1-2-3-10-32-25-7-5-4-6-24(25)29-26(30)22-9-8-21(14-23(22)27(29)31)28-15-18-11-19(16-28)13-20(12-18)17-28/h4-9,14,18-20H,2-3,10-13,15-17H2,1H3InChIKey
MHBRIPPULUNOKM-UHFFFAOYSA-NSynonyms
2(2butoxyphenyl)5(tricyclo(3311~37~)dec1yl)1Hisoindole13(2H)dione
5(1ADAMANTYL)2(2BUTOXYPHENYL)ISOINDOLE13DIONE
5ADAMANTANYL2(2BUTOXYPHENYL)BENZO(C)AZOLIDINE13DIONE
CCCCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C45CC6CC(C4)CC(C6)C5
InChI=1SC28H31NO3c123103225754624(25)2926(30)229821(1423(22)27(29)31)2815181119(1628)1320(1218)1728h49141820H2310131517H21H3
MFCD03034646
ZINC000004451419
ZINC04451419
ZINC4451419
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