N-(4-phenylmethoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide

Systemtic Name: N-(4-phenylmethoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-(4-benzyloxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-(4-phenylmethoxyphenyl)-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]benzamide IUPAC Name: N-(4-phenylmethoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-(4-benzoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C31H32N3O2+ MolecularWeight: 478.60468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2/c35-31(32-28-15-17-30(18-16-28)36-24-26-7-3-1-4-8-26)27-13-11-25(12-14-27)23-33-19-21-34(22-20-33)29-9-5-2-6-10-29/h1-18H,19-24H2,(H,32,35)/p+1