For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
benzenemethanamine, 4-chloro-N-[5-[4-(4-methylbenzoyl)-1-piperazinyl]-2-nitrophenyl]-
SpectraBase Compound ID 3I9Ot8iUHlL
InChI InChI=1S/C25H25ClN4O3/c1-18-2-6-20(7-3-18)25(31)29-14-12-28(13-15-29)22-10-11-24(30(32)33)23(16-22)27-17-19-4-8-21(26)9-5-19/h2-11,16,27H,12-15,17H2,1H3
InChIKey INGNQIRKKDRQHX-UHFFFAOYSA-N
Mol Weight 464.95 g/mol
Molecular Formula C25H25ClN4O3
Exact Mass 464.161518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I1u5msZebCO
Name [4-[3-[(4-chlorobenzyl)amino]-4-nitro-phenyl]piperazino]-(p-tolyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25ClN4O3
InChI InChI=1S/C25H25ClN4O3/c1-18-2-6-20(7-3-18)25(31)29-14-12-28(13-15-29)22-10-11-24(30(32)33)23(16-22)27-17-19-4-8-21(26)9-5-19/h2-11,16,27H,12-15,17H2,1H3
InChIKey INGNQIRKKDRQHX-UHFFFAOYSA-N
Molecular Weight 464.953 g/mol
SMILES N(c1c(N(=O)=O)ccc(N2CCN(C(c3ccc(cc3)C)=O)CC2)c1)Cc1ccc(cc1)Cl
SPLASH splash10-014i-7923000000-0a412491fbf65f3e0b98
Synonyms [4-[3-[(4-chlorophenyl)methylamino]-4-nitro-phenyl]piperazin-1-yl]-(4-methylphenyl)methanone [4-[3-[(4-chlorophenyl)methylamino]-4-nitro-phenyl]piperazin-1-yl]-(p-tolyl)methanone [4-[3-[(4-chlorophenyl)methylamino]-4-nitrophenyl]-1-piperazinyl]-(4-methylphenyl)methanone
Wiley ID 1455082