Vitas-M small molecule compound
4-[3-nitro-4-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Catalog ID
STK238638
SMILES [O-][N+](=O)c1cc(ccc1N1CCCC1)c1n[nH]c(=O)c2c1cccc2
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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 C18H16N4O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3/c23-18-14-6-2-1-5-13(14)17(19-20-18)12-7-8-15(16(11-12)22(24)25)21-9-3-4-10-21/h1-2,5-8,11H,3-4,9-10H2,(H,20,23)InChIKey
FPCLJERZGAKAAX-UHFFFAOYSA-NSynonyms
672914-30-6(O)(N+)(=O)c1cc(ccc1N1CCCC1)c1n(nH)c(=O)c2c1cccc2
4(3NITRO4(PYRROLIDIN1YL)PHENYL)12DIHYDROPHTHALAZIN1ONE
4(3nitro4(pyrrolidin1yl)phenyl)phthalazin1(2H)one
4(3NITRO4PYRROLIDIN1YLPHENYL)2HPHTHALAZIN1ONE
672914306
C1CCN(C1)C2=C(C=C(C=C2)C3=NNC(=O)C4=CC=CC=C43)(N+)(=O)(O)
InChI=1SC18H16N4O3c231814621513(14)17(192018)127815(16(1112)22(24)25)219341021h125811H34910H2(H2023)
MFCD04013250
ZINC000003908819
ZINC03908819
ZINC3908819
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