Vitas-M small molecule compound

17-(2-bromo-4-nitrophenyl)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)

Catalog ID
STL387123
SMILES O=C1N(C(=O)C2C1C1c3ccccc3C2c2c1cccc2)c1ccc(cc1Br)[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 C24H15BrN2O4 MW 475.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15BrN2O4/c25-17-11-12(27(30)31)9-10-18(17)26-23(28)21-19-13-5-1-2-6-14(13)20(22(21)24(26)29)16-8-4-3-7-15(16)19/h1-11,19-22H
InChIKey
HDIITRHIQFCCBV-UHFFFAOYSA-N
Synonyms

17(2bromo4nitrophenyl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=C(C=C(C=C6)(N+)(=O)(O))Br
InChI=1SC24H15BrN2O4c25171112(27(30)31)91018(17)2623(28)211913512614(13)20(22(21)24(26)29)16843715(16)19h1111922H
MFCD00338271
O=C1N(C(=O)C2C1C1c3ccccc3C2c2c1cccc2)c1ccc(cc1Br)(N+)(=O)(O)
ZINC000016183753
ZINC000017969776

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Available files

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