Vitas-M small molecule compound
9-(3-chlorobenzyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Catalog ID
STK577169
SMILES Clc1cccc(c1)CN1COc2c(C1)cc1c(c2C)oc(=O)c2c1CCC2
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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 C22H20ClNO3 MW 381.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO3/c1-13-20-15(9-19-17-6-3-7-18(17)22(25)27-21(13)19)11-24(12-26-20)10-14-4-2-5-16(23)8-14/h2,4-5,8-9H,3,6-7,10-12H2,1H3InChIKey
BHKYZFVMDIVRNG-UHFFFAOYSA-NSynonyms
850736-38-8850736388
9(3chlorobenzyl)6methyl23910tetrahydro1Hcyclopenta(34)chromeno(67e)(13)oxazin4(8H)one
9(3chlorobenzyl)6methyl23910tetrahydro8Hcyclopenta(34)chromeno(67e)(13)oxazin4(1H)one
CC1=C2C(=CC3=C1OCN(C3)CC4=CC(=CC=C4)Cl)C5=C(CCC5)C(=O)O2
InChI=1SC22H20ClNO3c1132015(9191763718(17)22(25)2721(13)19)1124(122620)101442516(23)814h24589H3671012H21H3
MFCD05693283
ZINC000057105272
ZINC57105272
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