[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C23H26ClN4O+ MolecularWeight: 409.93174

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C23H25ClN4O/c1-2-26-12-14-27(15-13-26)23(29)20-17-28(16-19-10-6-7-11-21(19)24)25-22(20)18-8-4-3-5-9-18/h3-11,17H,2,12-16H2,1H3/p+1