Vitas-M small molecule compound

methyl 4-[(3-methoxyphenyl)carbonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

Catalog ID
STK909011
SMILES COC(=O)C1Oc2ccccc2N(C1)C(=O)c1cccc(c1)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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c1-22-13-7-5-6-12(10-13)17(20)19-11-16(18(21)23-2)24-15-9-4-3-8-14(15)19/h3-10,16H,11H2,1-2H3
InChIKey
NEEPPTHZSBYRHQ-UHFFFAOYSA-N
Synonyms
880783-01-7
880783017
COC1=CC=CC(=C1)C(=O)N2CC(OC3=CC=CC=C32)C(=O)OC
InChI=1SC18H17NO5c1221375612(1013)17(20)191116(18(21)232)2415943814(15)19h31016H11H212H3
methyl4((3methoxyphenyl)carbonyl)34dihydro2H14benzoxazine2carboxylate
methyl4(3methoxybenzoyl)23dihydro14benzoxazine2carboxylate
MFCD06648286
ZINC000016753287
ZINC000016753289

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Available files

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