Vitas-M small molecule compound
9-carboxy-10-[2-(4-methoxyphenyl)-2-oxoethyl]-1,2,3,4-tetrahydroacridinium bromide
Catalog ID
STL281445
SMILES COc1ccc(cc1)C(=O)C[n+]1c2CCCCc2c(c2c1cccc2)C(=O)O.[Br-]
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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 C23H22BrNO4 MW 456.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO4.BrH/c1-28-16-12-10-15(11-13-16)21(25)14-24-19-8-4-2-6-17(19)22(23(26)27)18-7-3-5-9-20(18)24;/h2,4,6,8,10-13H,3,5,7,9,14H2,1H3;1HInChIKey
XPKXZFMVDVNXSW-UHFFFAOYSA-NSynonyms
301303-48-010(2(4methoxyphenyl)2oxoethyl)1234tetrahydroacridin10ium9carboxylicacidbromide
301303480
9carboxy10(2(4methoxyphenyl)2oxoethyl)1234tetrahydroacridiniumbromide
COC1=CC=C(C=C1)C(=O)C(N+)2=C3CCCCC3=C(C4=CC=CC=C42)C(=O)O(Br)
COc1ccc(cc1)C(=O)C(n+)1c2CCCCc2c(c2c1cccc2)C(=O)O(Br)
InChI=1SC23H21NO4BrHc12816121015(111316)21(25)142419842617(19)22(23(26)27)18735920(18)24h24681013H357914H21H31H
MFCD01419461
ZINC000003206575
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