3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: 3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: N-(4-benzyloxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: 3-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: N-(4-benzoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propionamide Formula: C22H31N3O3+2 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)CCO

Isomeric SMILES

C1C[NH+](CC[NH+]1CCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)CCO

InChI

InChI=1S/C22H29N3O3/c26-17-16-25-14-12-24(13-15-25)11-10-22(27)23-20-6-8-21(9-7-20)28-18-19-4-2-1-3-5-19/h1-9,26H,10-18H2,(H,23,27)/p+2