Vitas-M small molecule compound

(4-chloro-3-nitrophenyl)(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone

Catalog ID
STK858763
SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(c(c1)[N+](=O)[O-])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 C18H17ClN2O5 MW 376.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2O5/c1-25-16-8-11-5-6-20(10-13(11)9-17(16)26-2)18(22)12-3-4-14(19)15(7-12)21(23)24/h3-4,7-9H,5-6,10H2,1-2H3
InChIKey
NQLAVWOFZXRNAT-UHFFFAOYSA-N
Synonyms
879459-37-7
(4CHLORO3NITROPHENYL)(67DIMETHOXY34DIHYDRO1HISOQUINOLIN2YL)METHANONE
(4chloro3nitrophenyl)(67dimethoxy34dihydroisoquinolin2(1H)yl)methanone
879459377
COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O))OC
COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC18H17ClN2O5c125168115620(1013(11)917(16)262)18(22)123414(19)15(712)21(23)24h3479H5610H212H3
MFCD06612218
ZINC000002357230
ZINC02357230
ZINC2357230

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Available files

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