Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-8-methoxy-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL419744
SMILES COc1cc2OCCCOc2cc1C(=O)Nc1ccc(c(c1)Cl)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 C18H18ClNO4 MW 347.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO4/c1-11-4-5-12(8-14(11)19)20-18(21)13-9-16-17(10-15(13)22-2)24-7-3-6-23-16/h4-5,8-10H,3,6-7H2,1-2H3,(H,20,21)InChIKey
IEFYVXXKGSUYAU-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2OC)OCCCO3)Cl
InChI=1SC18H18ClNO4c1114512(814(11)19)2018(21)1391617(1015(13)222)247362316h45810H367H212H3(H2021)
MFCD27221154
N(3chloro4methylphenyl)7methoxy34dihydro2H15benzodioxepine8carboxamide
N(3chloro4methylphenyl)8methoxy34dihydro2H15benzodioxepine7carboxamide
ZINC000046077916
ZINC46077916
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