Vitas-M small molecule compound
1-ethyl-3,7-bis(4-methylphenyl)-3a,5a-dihydro-1H-[1]benzofuro[5,4,3-def]cinnolin-6-ium
Catalog ID
STL503662
SMILES CCN1N=C(c2ccc(cc2)C)C2c3c1ccc1c3C(C=C2)[O+]=C1c1ccc(cc1)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 C28H25N2O MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N2O/c1-4-30-23-15-13-22-26-24(31-28(22)20-11-7-18(3)8-12-20)16-14-21(25(23)26)27(29-30)19-9-5-17(2)6-10-19/h5-16,21,24H,4H2,1-3H3/q+1InChIKey
AXBSZOHMHPNITF-UHFFFAOYSA-NSynonyms
126843815
1ethyl37bis(4methylphenyl)3a5adihydro1H(1)benzofuro(543def)cinnolin6ium
5ethyl713bis(4methylphenyl)12oxa6aza5azoniatetracyclo(6520^(415)0^(1114))pentadeca1(13)246914hexaene
InChI=1SC28H25N2Oc1430231513222624(3128(22)2011718(3)81220)161421(25(23)26)27(2930)199517(2)61019h5162124H4H213H3q+1
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