Vitas-M small molecule compound

17-(4-methoxy-2-nitrophenyl)-1-methyl-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
STL374160
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1(C)c3c(C2c2c1cccc2)cccc3

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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 C26H20N2O5 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O5/c1-26-17-9-5-3-7-15(17)21(16-8-4-6-10-18(16)26)22-23(26)25(30)27(24(22)29)19-12-11-14(33-2)13-20(19)28(31)32/h3-13,21-23H,1-2H3
InChIKey
FJFOMXZIHIXXFR-UHFFFAOYSA-N
Synonyms

17(4methoxy2nitrophenyl)1methyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=C(C=C(C=C6)OC)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1(C)c3c(C2c2c1cccc2)cccc3
InChI=1SC26H20N2O5c12617953715(17)21(168461018(16)26)2223(26)25(30)27(24(22)29)19121114(332)1320(19)28(31)32h3132123H12H3
MFCD01170961
ZINC000006232798
ZINC000006232840

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Available files

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