Vitas-M small molecule compound
4'-(3-nitrophenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one
Catalog ID
STK569691
SMILES O=C1c2ccccc2CCC21N=NCC2c1cccc(c1)[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 C18H15N3O3 MW 321.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O3/c22-17-15-7-2-1-4-12(15)8-9-18(17)16(11-19-20-18)13-5-3-6-14(10-13)21(23)24/h1-7,10,16H,8-9,11H2InChIKey
ACCOTTALHJCHOV-UHFFFAOYSA-NSynonyms
714938-75-74(3nitrophenyl)3445tetrahydro1Hspiro(naphthalene23pyrazol)1one
4(3nitrophenyl)spiro(34dihydronaphthalene2534dihydropyrazole)1one
714938757
C1CC2(C(CN=N2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C4=CC=CC=C41
InChI=1SC18H15N3O3c221715721412(15)8918(17)16(11192018)1353614(1013)21(23)24h171016H8911H2
MFCD03687453
O=C1c2ccccc2CCC21N=NCC2c1cccc(c1)(N+)(=O)(O)
ZINC000005253030
ZINC000005253038
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