Vitas-M small molecule compound

methyl 4-[(4-chlorophenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

Catalog ID
STK515415
SMILES COC(=O)C1Oc2ccccc2N(C1)C(=O)COc1ccc(cc1)Cl

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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 C18H16ClNO5 MW 361.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO5/c1-23-18(22)16-10-20(14-4-2-3-5-15(14)25-16)17(21)11-24-13-8-6-12(19)7-9-13/h2-9,16H,10-11H2,1H3
InChIKey
KHNQMEYYRKRLHN-UHFFFAOYSA-N
Synonyms
879947-76-9
879947769
COC(=O)C1CN(C2=CC=CC=C2O1)C(=O)COC3=CC=C(C=C3)Cl
InChI=1SC18H16ClNO5c12318(22)161020(14423515(14)2516)17(21)1124138612(19)7913h2916H1011H21H3
methyl4((4chlorophenoxy)acetyl)34dihydro2H14benzoxazine2carboxylate
methyl4(2(4chlorophenoxy)acetyl)23dihydro14benzoxazine2carboxylate
MFCD06645244
ZINC000014571580
ZINC000014571581

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Available files

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