2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide Formula: C18H26ClN5O+2 MolecularWeight: 363.88494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H24ClN5O/c1-13-18(14(2)22-21-13)20-17(25)12-24-9-7-23(8-10-24)11-15-3-5-16(19)6-4-15/h3-6H,7-12H2,1-2H3,(H,20,25)(H,21,22)/p+2