2-phenyl-N-[3-[4-[3-(2-phenylethanoylamino)propyl]piperazin-1-ium-1-yl]propyl]ethanamide

Systemtic Name: 2-phenyl-N-[3-[4-[3-(2-phenylethanoylamino)propyl]piperazin-1-ium-1-yl]propyl]ethanamide Openeye Name: 2-phenyl-N-[3-[4-[3-[(2-phenylacetyl)amino]propyl]piperazin-1-ium-1-yl]propyl]acetamide CAS Name: N-[3-[4-[3-[(1-oxo-2-phenylethyl)amino]propyl]-1-piperazin-1-iumyl]propyl]-2-phenylacetamide IUPAC Name: 2-phenyl-N-[3-[4-[3-[(2-phenylacetyl)amino]propyl]piperazin-1-ium-1-yl]propyl]acetamide Traditional Name: 2-phenyl-N-[3-[4-[3-[(2-phenylacetyl)amino]propyl]piperazin-1-ium-1-yl]propyl]acetamide Formula: C26H37N4O2+ MolecularWeight: 437.59758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCNC(=O)CC2=CC=CC=C2)CCCNC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCCNC(=O)CC2=CC=CC=C2)CCCNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H36N4O2/c31-25(21-23-9-3-1-4-10-23)27-13-7-15-29-17-19-30(20-18-29)16-8-14-28-26(32)22-24-11-5-2-6-12-24/h1-6,9-12H,7-8,13-22H2,(H,27,31)(H,28,32)/p+1