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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(C2=CC=CC=C2)[N+]3(CCNCC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(C2=CC=CC=C2)[N+]3(CCNCC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O/c1-21(30)28-25-14-12-24(13-15-25)26(23-10-6-3-7-11-23)29(18-16-27-17-19-29)20-22-8-4-2-5-9-22/h2-15,26-27H,16-20H2,1H3/p+1