Vitas-M small molecule compound

17-(2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde (non-preferred name)

Catalog ID
STK264159
SMILES O=CC12C3C(C(=O)N(C3=O)c3ccccc3[N+](=O)[O-])C(c3c1cccc3)c1c2cccc1

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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 C25H16N2O5 MW 424.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16N2O5/c28-13-25-16-9-3-1-7-14(16)20(15-8-2-4-10-17(15)25)21-22(25)24(30)26(23(21)29)18-11-5-6-12-19(18)27(31)32/h1-13,20-22H
InChIKey
CRAOMVRUTBYWOR-UHFFFAOYSA-N
Synonyms
297158-40-8
17(2nitrophenyl)1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1carbaldehyde(nonpreferredname)
297158408
C1=CC=C2C(=C1)C3C4C(C2(C5=CC=CC=C35)C=O)C(=O)N(C4=O)C6=CC=CC=C6(N+)(=O)(O)
InChI=1SC25H16N2O5c28132516931714(16)20(158241017(15)25)2122(25)24(30)26(23(21)29)1811561219(18)27(31)32h1132022H
MFCD00577907
O=CC12C3C(C(=O)N(C3=O)c3ccccc3(N+)(=O)(O))C(c3c1cccc3)c1c2cccc1
ZINC000009056359
ZINC000009056364

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Available files

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