Vitas-M small molecule compound
4,4,6-trimethyl-1,2-dioxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 2-chloro-5-nitrobenzoate
Catalog ID
STK132043
SMILES CC1CC(C)(C)N2c3c1cc(cc3C(=O)C2=O)OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]
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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 C21H17ClN2O6 MW 428.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O6/c1-10-9-21(2,3)23-17-13(10)7-12(8-15(17)18(25)19(23)26)30-20(27)14-6-11(24(28)29)4-5-16(14)22/h4-8,10H,9H2,1-3H3InChIKey
OCHFJEZFHYKUFU-UHFFFAOYSA-NSynonyms
511514-85-5446trimethyl12dioxo1256tetrahydro4Hpyrrolo(321ij)quinolin8yl2chloro5nitrobenzoate
446trimethyl12dioxo2456tetrahydro1Hpyrrolo(321ij)quinolin8yl2chloro5nitrobenzoate
511514855
CC1CC(C)(C)N2c3c1cc(cc3C(=O)C2=O)OC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
CC1CC(N2C3=C1C=C(C=C3C(=O)C2=O)OC(=O)C4=C(C=CC(=C4)(N+)(=O)(O))Cl)(C)C
InChI=1SC21H17ClN2O6c110921(23)231713(10)712(815(17)18(25)19(23)26)3020(27)14611(24(28)29)4516(14)22h4810H9H213H3
MFCD03490305
ZINC000002202505
ZINC000002202507
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