Vitas-M small molecule compound
methyl 4-{2-[5-methyl-2-(propan-2-yl)phenoxy]propanoyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Catalog ID
STK882320
SMILES COC(=O)C1Oc2ccccc2N(C1)C(=O)C(Oc1cc(C)ccc1C(C)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 C23H27NO5 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO5/c1-14(2)17-11-10-15(3)12-20(17)28-16(4)22(25)24-13-21(23(26)27-5)29-19-9-7-6-8-18(19)24/h6-12,14,16,21H,13H2,1-5H3InChIKey
ORVIUOAIGAJOEH-UHFFFAOYSA-NSynonyms
879948-49-92H14BENZOXAZINE2CARBOXYLICACID34DIHYDRO4(2(5METHYL2(1METHYLETHYL)PHENOXY)1OXOPROPYL)METHYLESTER
879948499
CC1=CC(=C(C=C1)C(C)C)OC(C)C(=O)N2CC(OC3=CC=CC=C32)C(=O)OC
InChI=1SC23H27NO5c114(2)17111015(3)1220(17)2816(4)22(25)241321(23(26)275)2919976818(19)24h612141621H13H215H3
METHYL4(2(2ISOPROPYL5METHYLPHENOXY)PROPANOYL)34DIHYDRO2H14BENZOXAZINE2CARBOXYLATE
methyl4(2(5methyl2(propan2yl)phenoxy)propanoyl)34dihydro2H14benzoxazine2carboxylate
methyl4(2(5methyl2propan2ylphenoxy)propanoyl)23dihydro14benzoxazine2carboxylate
MFCD06646112
ZINC000006810872
ZINC000006810875
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