Vitas-M small molecule compound
5-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
Catalog ID
STK541871
SMILES OC(=O)CCCC(=O)N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1ccccc1
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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 C20H19N3O5 MW 381.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5/c24-19(10-5-11-20(25)26)22-18(15-8-4-9-16(12-15)23(27)28)13-17(21-22)14-6-2-1-3-7-14/h1-4,6-9,12,18H,5,10-11,13H2,(H,25,26)InChIKey
KVTYHYDIPOCBEI-UHFFFAOYSA-NSynonyms
333304-92-0333304920
5(3(3NITROPHENYL)5PHENYL34DIHYDROPYRAZOL2YL)5OXOPENTANOICACID
5(5(3NITROPHENYL)3PHENYL(2PYRAZOLINYL))5OXOPENTANOICACID
5(5(3nitrophenyl)3phenyl45dihydro1Hpyrazol1yl)5oxopentanoicacid
5(5(3NITROPHENYL)3PHENYL45DIHYDROPYRAZOL1YL)5OXOPENTANOICACID
C1C(N(N=C1C2=CC=CC=C2)C(=O)CCCC(=O)O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC20H19N3O5c2419(1051120(25)26)2218(1584916(1215)23(27)28)1317(2122)146213714h14691218H5101113H2(H2526)
MFCD02732610
OC(=O)CCCC(=O)N1N=C(CC1c1cccc(c1)(N+)(=O)(O))c1ccccc1
ZINC000000907721
ZINC000000907723
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