N-(4-phenoxyphenyl)-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-(4-phenoxyphenyl)-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-(4-phenoxyphenyl)-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-(4-phenoxyphenyl)-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-phenoxyphenyl)-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-(4-phenoxyphenyl)-2-piperazin-1-ium-1-yl-acetamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCN1)CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2/c22-18(14-21-12-10-19-11-13-21)20-15-6-8-17(9-7-15)23-16-4-2-1-3-5-16/h1-9,19H,10-14H2,(H,20,22)/p+1