Vitas-M small molecule compound

3-(1,3-benzodioxol-5-ylmethyl)-11-chloro-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one

Catalog ID
STK829518
SMILES Clc1cc2c(c3c1OCN(C3)Cc1ccc3c(c1)OCO3)oc(=O)c1c2CCC1

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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 C22H18ClNO5 MW 411.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClNO5/c23-17-7-15-13-2-1-3-14(13)22(25)29-20(15)16-9-24(10-26-21(16)17)8-12-4-5-18-19(6-12)28-11-27-18/h4-7H,1-3,8-11H2
InChIKey
UEPUZSMDIXRZHZ-UHFFFAOYSA-N
Synonyms
849921-29-5
10(2HBENZO(34D)13DIOXOLAN5YLMETHYL)7CHLORO345TRIHYDRO9H11HCYCLOPENTA(12C)13OXAZAPERHYDROINO(65H)CHROMEN2ONE
3(13benzodioxol5ylmethyl)11chloro3489tetrahydro2Hcyclopenta(34)chromeno(87e)(13)oxazin6(7H)one
3(benzo(d)(13)dioxol5ylmethyl)11chloro3489tetrahydro2Hcyclopenta(34)chromeno(87e)(13)oxazin6(7H)one
849921295
C1CC2=C(C1)C(=O)OC3=C4CN(COC4=C(C=C23)Cl)CC5=CC6=C(C=C5)OCO6
InChI=1SC22H18ClNO5c23177151321314(13)22(25)2920(15)16924(102621(16)17)812451819(612)28112718h47H13811H2
MFCD05689367
ZINC000019882434
ZINC19882434

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Available files

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