Vitas-M small molecule compound
4-[(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]phenyl 3-nitrobenzoate
Catalog ID
STK998899
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(cc1)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)18-7-2-1-6-17(18)21(19)27)25-14-8-10-16(11-9-14)32-23(29)13-4-3-5-15(12-13)26(30)31/h1-12,25HInChIKey
MQCXBXSDNMCFGS-UHFFFAOYSA-NSynonyms
489414-29-1(4((3CHLORO14DIOXONAPHTHALEN2YL)AMINO)PHENYL)3NITROBENZOATE
4((3chloro14dioxo14dihydronaphthalen2yl)amino)phenyl3nitrobenzoate
489414291
C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC23H13ClN2O6c241920(22(28)18721617(18)21(19)27)251481016(11914)3223(29)1343515(1213)26(30)31h11225H
MFCD03296379
O=C(c1cccc(c1)(N+)(=O)(O))Oc1ccc(cc1)NC1=C(Cl)C(=O)c2c(C1=O)cccc2
ZINC000002255505
ZINC02255505
ZINC2255505
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