N-(phenylmethyl)-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]benzamide

Systemtic Name: N-(phenylmethyl)-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]benzamide Openeye Name: N-benzyl-4-[(4-benzylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-(phenylmethyl)-4-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]benzamide IUPAC Name: N-benzyl-4-[(4-benzylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-benzyl-4-[(4-benzylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C26H30N3O+ MolecularWeight: 400.5359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O/c30-26(27-19-22-7-3-1-4-8-22)25-13-11-24(12-14-25)21-29-17-15-28(16-18-29)20-23-9-5-2-6-10-23/h1-14H,15-21H2,(H,27,30)/p+1