N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C25H36N4O+2 MolecularWeight: 408.57954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H34N4O/c30-25(23-11-9-22(10-12-23)21-28-14-5-2-6-15-28)26-13-16-27-17-19-29(20-18-27)24-7-3-1-4-8-24/h1,3-4,7-12H,2,5-6,13-21H2,(H,26,30)/p+2