Vitas-M small molecule compound
4-[(7E)-7-(4-nitrobenzylidene)-3-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-4-oxobutanoic acid
Catalog ID
STK889114
SMILES OC(=O)CCC(=O)N1N=C2C(C1c1ccc(cc1)[N+](=O)[O-])CCC/C/2=C\c1ccc(cc1)[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 C24H22N4O7 MW 478.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O7/c29-21(12-13-22(30)31)26-24(16-6-10-19(11-7-16)28(34)35)20-3-1-2-17(23(20)25-26)14-15-4-8-18(9-5-15)27(32)33/h4-11,14,20,24H,1-3,12-13H2,(H,30,31)/b17-14+InChIKey
CAHQPCBBYHCAHB-SAPNQHFASA-NSynonyms
4((7E)3(4NITROPHENYL)7((4NITROPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)4OXOBUTANOICACID
4((7E)7(4nitrobenzylidene)3(4nitrophenyl)33a4567hexahydro2Hindazol2yl)4oxobutanoicacid
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)(N+)(=O)(O))C1)C(=O)CCC(=O)O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC24H22N4O7c2921(121322(30)31)2624(1661019(11716)28(34)35)2031217(23(20)2526)14154818(9515)27(32)33h411142024H131213H2(H3031)b1714+
MFCD01627196
OC(=O)CCC(=O)N1N=C2C(C1c1ccc(cc1)(N+)(=O)(O))CCCC2=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000009090680
ZINC000012560385
Check stock
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