Vitas-M small molecule compound
2-[4-(3-methylphenoxy)phenyl]-4-nitro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK252439
SMILES Cc1cccc(c1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cccc2[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 C21H14N2O5 MW 374.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O5/c1-13-4-2-5-16(12-13)28-15-10-8-14(9-11-15)22-20(24)17-6-3-7-18(23(26)27)19(17)21(22)25/h2-12H,1H3InChIKey
HXPLPWNHMZYANI-UHFFFAOYSA-NSynonyms
2(4(3METHYLPHENOXY)PHENYL)4NITRO1HISOINDOLE13(2H)DIONE
2(4(3METHYLPHENOXY)PHENYL)4NITROISOINDOLE13DIONE
4NITRO2(4(3METHYLPHENOXY)PHENYL)1HISOINDOLE13(2H)DIONE
CC1=CC(=CC=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)(N+)(=O)(O)
Cc1cccc(c1)Oc1ccc(cc1)N1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
InChI=1SC21H14N2O5c11342516(1213)281510814(91115)2220(24)1763718(23(26)27)19(17)21(22)25h212H1H3
MFCD01616477
ZINC000000990715
ZINC00990715
ZINC990715
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