Vitas-M small molecule compound

3-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]phenyl 3-nitrobenzoate

Catalog ID
STL335505
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Oc1cccc(c1)NC1=C(Cl)C(=O)c2c(C1=O)cccc2

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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 C23H13ClN2O6 MW 448.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O6/c24-19-20(22(28)18-10-2-1-9-17(18)21(19)27)25-14-6-4-8-16(12-14)32-23(29)13-5-3-7-15(11-13)26(30)31/h1-12,25H
InChIKey
MSDIIEGEZSQQRB-UHFFFAOYSA-N
Synonyms
498570-43-7
(3((3CHLORO14DIOXONAPHTHALEN2YL)AMINO)PHENYL)3NITROBENZOATE
3((3chloro14dioxo14dihydronaphthalen2yl)amino)phenyl3nitrobenzoate
498570437
C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NC3=CC(=CC=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC23H13ClN2O6c241920(22(28)181021917(18)21(19)27)251464816(1214)3223(29)1353715(1113)26(30)31h11225H
MFCD03302153
O=C(c1cccc(c1)(N+)(=O)(O))Oc1cccc(c1)NC1=C(Cl)C(=O)c2c(C1=O)cccc2
ZINC000002350063
ZINC02350063
ZINC2350063

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Available files

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