Vitas-M small molecule compound
N-[(4E)-8-ethoxy-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-ylidene](phenyl)methanaminium
Catalog ID
STK792860
SMILES CCOc1ccc/c(=[NH+]\Cc2ccccc2)/c2c1c(C)[nH]c2C
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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 C20H23N2O MW 307.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O/c1-4-23-18-12-8-11-17(19-14(2)22-15(3)20(18)19)21-13-16-9-6-5-7-10-16/h5-12,22H,4,13H2,1-3H3/p+1/b21-17+InChIKey
QLMBVVXPQYFNCJ-HEHNFIMWSA-OSynonyms
(E)N(8ethoxy13dimethylcyclohepta(c)pyrrol4(2H)ylidene)1phenylmethanaminiumperchlorate
(O)(Cl)(=O)(=O)=OCCOc1cccc(=(NH+)Cc2ccccc2)c2c1c(C)(nH)c2C
CCOc1cccc(=(NH+)Cc2ccccc2)c2c1c(C)(nH)c2C
MFCD02997296
N((4E)8ethoxy13dimethylcyclohepta(c)pyrrol4(2H)ylidene)(phenyl)methanaminium
ZINC000095481346
ZINC000097475377
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