Vitas-M small molecule compound
1-[8-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]ethanone
Catalog ID
STK833536
SMILES COc1ccc2c(c1)C1=NN(C(C1CC2)c1ccc(cc1)[N+](=O)[O-])C(=O)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 C20H19N3O4 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4/c1-12(24)22-20(14-3-7-15(8-4-14)23(25)26)17-10-6-13-5-9-16(27-2)11-18(13)19(17)21-22/h3-5,7-9,11,17,20H,6,10H2,1-2H3InChIKey
NLGGDVOHSMEHTA-UHFFFAOYSA-NSynonyms
312615-91-11(8methoxy3(4nitrophenyl)33a45tetrahydro2Hbenzo(g)indazol2yl)ethanone
1(8METHOXY3(4NITROPHENYL)33A45TETRAHYDROBENZO(G)INDAZOL2YL)ETHANONE
2ACETYL8METHOXY3(4NITROPHENYL)33A45TETRAHYDRO2HBENZO(G)INDAZOLE
312615911
CC(=O)N1C(C2CCC3=C(C2=N1)C=C(C=C3)OC)C4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc2c(c1)C1=NN(C(C1CC2)c1ccc(cc1)(N+)(=O)(O))C(=O)C
ETHANONE1(33A45TETRAHYDRO8METHOXY3(4NITROPHENYL)2HNAPHTHO(12C)PYRAZOL2YL)
InChI=1SC20H19N3O4c112(24)2220(143715(8414)23(25)26)17106135916(272)1118(13)19(17)2122h3579111720H610H212H3
MFCD00558675
ZINC000000763010
ZINC000003995423
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