2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(3-phenylpropyl)acetamide Formula: C22H30ClN3O+2 MolecularWeight: 387.9461

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Cl)CC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)Cl)CC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C22H28ClN3O/c23-21-10-4-8-20(16-21)17-25-12-14-26(15-13-25)18-22(27)24-11-5-9-19-6-2-1-3-7-19/h1-4,6-8,10,16H,5,9,11-15,17-18H2,(H,24,27)/p+2