Vitas-M small molecule compound
14-(2-bromophenyl)-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Catalog ID
STK588121
SMILES O=C1CC(C)(C)CC2=C1C(C=C1N2CCc2c1cc1c(c2)OCO1)c1ccccc1Br
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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 C26H24BrNO3 MW 478.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24BrNO3/c1-26(2)12-21-25(22(29)13-26)18(16-5-3-4-6-19(16)27)10-20-17-11-24-23(30-14-31-24)9-15(17)7-8-28(20)21/h3-6,9-11,18H,7-8,12-14H2,1-2H3InChIKey
ILMXPQDGJUMUAM-UHFFFAOYSA-NSynonyms
879562-43-314(2bromophenyl)33dimethyl2346714hexahydro1H(13)dioxolo(4567)isoquinolino(21a)quinolin1one
14(2bromophenyl)33dimethyl2346714hexahydro1H(13)dioxolo(67)isoquino(21a)quinolin1one
879562433
CC1(CC2=C(C(C=C3N2CCC4=CC5=C(C=C43)OCO5)C6=CC=CC=C6Br)C(=O)C1)C
InChI=1SC26H24BrNO3c126(2)122125(22(29)1326)18(16534619(16)27)102017112423(30143124)915(17)7828(20)21h3691118H781214H212H3
MFCD07640354
ZINC000009041404
ZINC000009129529
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