Vitas-M small molecule compound
methyl 4-[2-(2,3-dimethylphenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Catalog ID
STK907502
SMILES COC(=O)C1Oc2ccccc2N(C1)C(=O)C(Oc1cccc(c1C)C)C
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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 C21H23NO5 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5/c1-13-8-7-11-17(14(13)2)26-15(3)20(23)22-12-19(21(24)25-4)27-18-10-6-5-9-16(18)22/h5-11,15,19H,12H2,1-4H3InChIKey
LKBLYLAGLMSNPG-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)OC(C)C(=O)N2CC(OC3=CC=CC=C32)C(=O)OC)C
InChI=1SC21H23NO5c113871117(14(13)2)2615(3)20(23)221219(21(24)254)27181065916(18)22h5111519H12H214H3
methyl4(2(23dimethylphenoxy)propanoyl)23dihydro14benzoxazine2carboxylate
methyl4(2(23dimethylphenoxy)propanoyl)34dihydro2H14benzoxazine2carboxylate
MFCD06646547
ZINC000006810842
ZINC000006810845
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