Vitas-M small molecule compound

3-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine

Catalog ID
STK403936
SMILES Cc1cc2OCN(Cc2c(c1Cl)C)Cc1ccc2c(c1)OCO2

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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 C18H18ClNO3 MW 331.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO3/c1-11-5-16-14(12(2)18(11)19)8-20(9-21-16)7-13-3-4-15-17(6-13)23-10-22-15/h3-6H,7-10H2,1-2H3
InChIKey
POIZMAOBQIRWST-UHFFFAOYSA-N
Synonyms

2HBENZO(E)(13)OXAZINE3BENZO(13)DIOXOL5YLMETHYL6CHLORO57DIMETHYL34DIHYDRO
3(13BENZODIOXOL5YLMETHYL)6CHLORO57DIMETHYL24DIHYDRO13BENZOXAZINE
3(13benzodioxol5ylmethyl)6chloro57dimethyl34dihydro2H13benzoxazine
CC1=CC2=C(CN(CO2)CC3=CC4=C(C=C3)OCO4)C(=C1Cl)C
InChI=1SC18H18ClNO3c11151614(12(2)18(11)19)820(92116)713341517(613)23102215h36H710H212H3
MFCD03632697
ZINC000019848817
ZINC19848817

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.