Vitas-M small molecule compound
4,4,6-trimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-8-yl 4-nitrobenzoate
Catalog ID
STK508424
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Oc1cc2C(=CC(N3c2c(c1)C(=O)C3=O)(C)C)C
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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 C21H16N2O6 MW 392.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O6/c1-11-10-21(2,3)22-17-15(11)8-14(9-16(17)18(24)19(22)25)29-20(26)12-4-6-13(7-5-12)23(27)28/h4-10H,1-3H3InChIKey
WURMITIIZPFUKT-UHFFFAOYSA-NSynonyms
522652-21-7446trimethyl12dioxo12dihydro4Hpyrrolo(321ij)quinolin8yl4nitrobenzoate
446trimethyl12dioxo24dihydro1Hpyrrolo(321ij)quinolin8yl4nitrobenzoate
522652217
CC1=CC(N2C3=C(C=C(C=C13)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C2=O)(C)C
InChI=1SC21H16N2O6c1111021(23)221715(11)814(916(17)18(24)19(22)25)2920(26)124613(7512)23(27)28h410H13H3
MFCD03488017
O=C(c1ccc(cc1)(N+)(=O)(O))Oc1cc2C(=CC(N3c2c(c1)C(=O)C3=O)(C)C)C
ZINC000001888794
ZINC01888794
ZINC1888794
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