N-(2-aminophenyl)-3-(4-propylpiperazin-4-ium-1-yl)propanamide

Systemtic Name: N-(2-aminophenyl)-3-(4-propylpiperazin-4-ium-1-yl)propanamide Openeye Name: N-(2-aminophenyl)-3-(4-propylpiperazin-4-ium-1-yl)propanamide CAS Name: N-(2-aminophenyl)-3-(4-propyl-1-piperazin-4-iumyl)propanamide IUPAC Name: N-(2-aminophenyl)-3-(4-propylpiperazin-4-ium-1-yl)propanamide Traditional Name: N-(2-aminophenyl)-3-(4-propylpiperazin-4-ium-1-yl)propionamide Formula: C16H27N4O+ MolecularWeight: 291.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CCC(=O)NC2=CC=CC=C2N

Isomeric SMILES

CCC[NH+]1CCN(CC1)CCC(=O)NC2=CC=CC=C2N

InChI

InChI=1S/C16H26N4O/c1-2-8-19-10-12-20(13-11-19)9-7-16(21)18-15-6-4-3-5-14(15)17/h3-6H,2,7-13,17H2,1H3,(H,18,21)/p+1