N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-(4-phenylphenoxy)ethanamide

Systemtic Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-(4-phenylphenoxy)ethanamide Openeye Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-(4-phenylphenoxy)acetamide CAS Name: N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-2-(4-phenylphenoxy)acetamide IUPAC Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-(4-phenylphenoxy)acetamide Traditional Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-(4-phenylphenoxy)acetamide Formula: C22H31N3O2+2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC(=O)COC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O2/c1-24-14-16-25(17-15-24)13-5-12-23-22(26)18-27-21-10-8-20(9-11-21)19-6-3-2-4-7-19/h2-4,6-11H,5,12-18H2,1H3,(H,23,26)/p+2