N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C[NH+]2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C[NH+]2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-20-6-5-9-22(18-20)28-17-11-24-23(27)19-26-15-13-25(14-16-26)12-10-21-7-3-2-4-8-21/h2-9,18H,10-17,19H2,1H3,(H,24,27)/p+1