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5-Cyano-6-ethoxy-3-formyl-2-[N-4-(4-chlorophenyl)piperazinyl]-4-phenylpyridine
SpectraBase Compound ID ImsRBMHDqdY
InChI InChI=1S/C25H23ClN4O2/c1-2-32-25-21(16-27)23(18-6-4-3-5-7-18)22(17-31)24(28-25)30-14-12-29(13-15-30)20-10-8-19(26)9-11-20/h3-11,17H,2,12-15H2,1H3
InChIKey DCFRGJSFPWPOBE-UHFFFAOYSA-N
Mol Weight 446.94 g/mol
Molecular Formula C25H23ClN4O2
Exact Mass 446.150954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67JKW1H66Qs
Name 5-Cyano-6-ethoxy-3-formyl-2-[N-4-(4-chlorophenyl)piperazinyl]-4-phenylpyridine
Alternate Name(s) 6-[4-(4-chlorophenyl)-1-piperazinyl]-2-ethoxy-5-formyl-4-phenylnicotinonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23ClN4O2
InChI InChI=1S/C25H23ClN4O2/c1-2-32-25-21(16-27)23(18-6-4-3-5-7-18)22(17-31)24(28-25)30-14-12-29(13-15-30)20-10-8-19(26)9-11-20/h3-11,17H,2,12-15H2,1H3
InChIKey DCFRGJSFPWPOBE-UHFFFAOYSA-N
Molecular Weight 446.938 g/mol
SMILES c1(c(c(-c2ccccc2)c(c(n1)OCC)C#N)C=O)N1CCN(CC1)c1ccc(cc1)Cl
SPLASH splash10-014i-0950100000-335ac4883091ff5a737c
Source of Spectrum H1-36-1342-2
Wiley ID 755346