N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C23H33N4O+ MolecularWeight: 381.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)C[NH+]1CCN(CC1)C2=CC=CC=C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C23H32N4O/c1-3-26(22-11-7-8-20(2)18-22)13-12-24-23(28)19-25-14-16-27(17-15-25)21-9-5-4-6-10-21/h4-11,18H,3,12-17,19H2,1-2H3,(H,24,28)/p+1