Vitas-M small molecule compound
2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl 3-chlorobenzoate
Catalog ID
STL013195
SMILES Cc1ccc2c(c1)N(CCO2)C(=O)COC(=O)c1cccc(c1)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 C18H16ClNO4 MW 345.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO4/c1-12-5-6-16-15(9-12)20(7-8-23-16)17(21)11-24-18(22)13-3-2-4-14(19)10-13/h2-6,9-10H,7-8,11H2,1H3InChIKey
IRXCFQKEYLSSRE-UHFFFAOYSA-NSynonyms
(2(6methyl23dihydro14benzoxazin4yl)2oxoethyl)3chlorobenzoate
2(6methyl23dihydro4H14benzoxazin4yl)2oxoethyl3chlorobenzoate
CC1=CC2=C(C=C1)OCCN2C(=O)COC(=O)C3=CC(=CC=C3)Cl
InChI=1SC18H16ClNO4c112561615(912)20(782316)17(21)112418(22)1332414(19)1013h26910H7811H21H3
MFCD18186028
ZINC000051356113
ZINC51356113
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