4-[4-(4-ethanoylpiperazin-1-ium-1-yl)piperidin-1-yl]-N-[(1S)-1-phenylethyl]benzamide

Systemtic Name: 4-[4-(4-ethanoylpiperazin-1-ium-1-yl)piperidin-1-yl]-N-[(1S)-1-phenylethyl]benzamide Openeye Name: 4-[4-(4-acetylpiperazin-1-ium-1-yl)-1-piperidyl]-N-[(1S)-1-phenylethyl]benzamide CAS Name: 4-[4-(4-acetyl-1-piperazin-1-iumyl)-1-piperidinyl]-N-[(1S)-1-phenylethyl]benzamide IUPAC Name: 4-[4-(4-acetylpiperazin-1-ium-1-yl)piperidin-1-yl]-N-[(1S)-1-phenylethyl]benzamide Traditional Name: 4-[4-(4-acetylpiperazin-1-ium-1-yl)piperidino]-N-[(1S)-1-phenylethyl]benzamide Formula: C26H35N4O2+ MolecularWeight: 435.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+]4CCN(CC4)C(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+]4CCN(CC4)C(=O)C

InChI

InChI=1S/C26H34N4O2/c1-20(22-6-4-3-5-7-22)27-26(32)23-8-10-24(11-9-23)29-14-12-25(13-15-29)30-18-16-28(17-19-30)21(2)31/h3-11,20,25H,12-19H2,1-2H3,(H,27,32)/p+1/t20-/m0/s1