N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-propyl-pentanamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-propyl-pentanamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-propyl-pentanamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-2-propylpentanamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-propylpentanamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-2-propyl-valeramide Formula: C20H34N3O+ MolecularWeight: 332.50346

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NCC[NH+]1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

CCCC(CCC)C(=O)NCC[NH+]1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C20H33N3O/c1-3-8-18(9-4-2)20(24)21-12-13-22-14-16-23(17-15-22)19-10-6-5-7-11-19/h5-7,10-11,18H,3-4,8-9,12-17H2,1-2H3,(H,21,24)/p+1