Vitas-M small molecule compound
(7E)-7-[(4-methylphenyl)iminio]-4-nitrocyclohepta-1,3,5-trien-1-olate
Catalog ID
STK562682
SMILES Cc1ccc(cc1)/[NH+]=c/1\ccc(ccc1[O-])[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 C14H12N2O3 MW 256.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O3/c1-10-2-4-11(5-3-10)15-13-8-6-12(16(18)19)7-9-14(13)17/h2-9H,1H3,(H,15,17)InChIKey
NBHUALIFNSDNBD-UHFFFAOYSA-NSynonyms
332177-89-6(7E)7((4methylphenyl)iminio)4nitrocyclohepta135trien1olate
2((4METHYLPHENYL)AMINO)5NITROCYCLOHEPTA246TRIEN1ONE
2(4METHYLANILINO)5NITRO1CYCLOHEPTA246TRIENONE
2(4METHYLANILINO)5NITROCYCLOHEPTA246TRIEN1ONE
332177896
5NITRO2((4METHYLPHENYL)AMINO)CYCLOHEPTA246TRIEN1ONE
5NITRO2(PTOLUIDINO)CYCLOHEPTA246TRIEN1ONE
CC1=CC=C(C=C1)NC2=CC=C(C=CC2=O)(N+)(=O)(O)
Cc1ccc(cc1)(NH+)=c1ccc(ccc1(O))(N+)(=O)(O)
InChI=1SC14H12N2O3c1102411(5310)15138612(16(18)19)7914(13)17h29H1H3(H1517)
MFCD18244097
ZINC000004309921
ZINC04309921
ZINC4309921
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