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Vitas-M small molecule compound

6,7-dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isochromene

Catalog ID
STK736610
SMILES COc1cc2c(cc1OC)CCOC2c1ccccc1[N+](=O)[O-]

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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 C17H17NO5 MW 315.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO5/c1-21-15-9-11-7-8-23-17(13(11)10-16(15)22-2)12-5-3-4-6-14(12)18(19)20/h3-6,9-10,17H,7-8H2,1-2H3
InChIKey
CBQUSUJZWFYJKN-UHFFFAOYSA-N
Synonyms
92774-38-4
67dimethoxy1(2nitrophenyl)34dihydro1Hisochromene
67DIMETHOXY1(2NITROPHENYL)ISOCHROMANE
92774384
COC1=C(C=C2C(OCCC2=C1)C3=CC=CC=C3(N+)(=O)(O))OC
COc1cc2c(cc1OC)CCOC2c1ccccc1(N+)(=O)(O)
InChI=1SC17H17NO5c12115911782317(13(11)1016(15)222)12534614(12)18(19)20h3691017H78H212H3
MFCD08142192
ZINC000006668134
ZINC000006668135

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Available files

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