Vitas-M small molecule compound

4-(6-bromo-1,3-benzodioxol-5-yl)-8-methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline

Catalog ID
STL199508
SMILES COc1ccc2c(c1)C1C=CCC1C(N2)c1cc2OCOc2cc1Br

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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 C20H18BrNO3 MW 400.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrNO3/c1-23-11-5-6-17-14(7-11)12-3-2-4-13(12)20(22-17)15-8-18-19(9-16(15)21)25-10-24-18/h2-3,5-9,12-13,20,22H,4,10H2,1H3
InChIKey
JOKJMQHCVVMSMH-UHFFFAOYSA-N
Synonyms

4(6BROMANYL13BENZODIOXOL5YL)8METHOXY3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE
4(6bromo13benzodioxol5yl)8methoxy3a459btetrahydro3Hcyclopenta(c)quinoline
4(6BROMOBENZO(13)DIOXOL5YL)8METHOXY3A459BTETRAHYDRO3HCYCLOPENTA(C)QUINOLINE
COC1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC5=C(C=C4Br)OCO5
InChI=1SC20H18BrNO3c12311561714(711)1232413(12)20(2217)1581819(916(15)21)25102418h235912132022H410H21H3
MFCD02226377
ZINC000000871835
ZINC000113355206

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Available files

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