Vitas-M small molecule compound
4-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]imino}methyl]phenolate
Catalog ID
STL039694
SMILES [O-]c1ccc(cc1)/C=N/N1CC[NH+](CC1)Cc1cccc2c1cccc2
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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 C22H23N3O MW 345.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O/c26-21-10-8-18(9-11-21)16-23-25-14-12-24(13-15-25)17-20-6-3-5-19-4-1-2-7-22(19)20/h1-11,16,26H,12-15,17H2/b23-16+InChIKey
QPVDQAOIABHONF-XQNSMLJCSA-NSynonyms
306952-14-7(O)c1ccc(cc1)C=NN1CC(NH+)(CC1)Cc1cccc2c1cccc2
306952147
4((E)((4(naphthalen1ylmethyl)piperazin4ium1yl)imino)methyl)phenolate
4((E)(4(naphthalen1ylmethyl)piperazin4ium1yl)iminomethyl)phenolate
C1CN(CC(NH+)1CC2=CC=CC3=CC=CC=C32)N=CC4=CC=C(C=C4)(O)
InChI=1SC22H23N3Oc262110818(91121)162325141224(131525)172063519412722(19)20h1111626H121517H2b2316+
MFCD01914594
ZINC000019849105
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