Vitas-M small molecule compound

2-(2,3-dimethoxyphenyl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine

Catalog ID
STL421272
SMILES CCC1(CC)OC(Nc2c1cccc2)c1cccc(c1OC)OC

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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 C20H25NO3 MW 327.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO3/c1-5-20(6-2)15-11-7-8-12-16(15)21-19(24-20)14-10-9-13-17(22-3)18(14)23-4/h7-13,19,21H,5-6H2,1-4H3
InChIKey
XUOXNNSVEBZFJJ-UHFFFAOYSA-N
Synonyms
339239-76-8
2(23DIMETHOXYPHENYL)44DIETHYL12DIHYDRO31BENZOXAZINE
2(23dimethoxyphenyl)44diethyl14dihydro2H31benzoxazine
2H31BENZOXAZINE14DIHYDRO44DIETHYL2(23DIMETHOXYPHENYL)
339239768
CCC1(C2=CC=CC=C2NC(O1)C3=C(C(=CC=C3)OC)OC)CC
InChI=1SC20H25NO3c1520(62)1511781216(15)2119(2420)141091317(223)18(14)234h7131921H56H214H3
MFCD00735333
ZINC000004358216
ZINC000004358220

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Available files

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