Vitas-M small molecule compound

17-(4-chloro-2-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
STL387122
SMILES Clc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1c3c(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 C24H15ClN2O4 MW 430.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15ClN2O4/c25-12-9-10-17(18(11-12)27(30)31)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
LJMLCNSNGMXFGG-UHFFFAOYSA-N
Synonyms

17(4chloro2nitrophenyl)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)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3
InChI=1SC24H15ClN2O4c251291017(18(1112)27(30)31)2623(28)211913512614(13)20(22(21)24(26)29)16843715(16)19h1111922H
MFCD00338272
ZINC000004156727
ZINC000018255587

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Available files

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