Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK295662
SMILES Cc1ccc(cc1C)n1c(=O)c2cccc3c2c(c1=O)ccc3[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 C20H14N2O4 MW 346.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O4/c1-11-6-7-13(10-12(11)2)21-19(23)15-5-3-4-14-17(22(25)26)9-8-16(18(14)15)20(21)24/h3-10H,1-2H3InChIKey
AFXSNIBQIOHNPS-UHFFFAOYSA-NSynonyms
2(34dimethylphenyl)6nitro1Hbenzo(de)isoquinoline13(2H)dione
2(34DIMETHYLPHENYL)6NITROBENZO(DE)ISOQUINOLINE13DIONE
CC1=C(C=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O)C
Cc1ccc(cc1C)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O)
InChI=1SC20H14N2O4c1116713(1012(11)2)2119(23)155341417(22(25)26)9816(18(14)15)20(21)24h310H12H3
MFCD00371300
ZINC000000179733
ZINC00179733
ZINC179733
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