N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phenoxy-benzamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phenoxy-benzamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phenoxy-benzamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-phenoxybenzamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phenoxybenzamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-phenoxy-benzamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-2-27-16-18-28(19-17-27)24-11-7-6-10-23(24)26-25(29)20-12-14-22(15-13-20)30-21-8-4-3-5-9-21/h3-15H,2,16-19H2,1H3,(H,26,29)/p+1