(2S)-2-[4-(4-aminophenyl)piperazin-1-ium-1-yl]-N-propyl-propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)[NH+]1CCN(CC1)C2=CC=C(C=C2)N

Isomeric SMILES

CCCNC(=O)[C@H](C)[NH+]1CCN(CC1)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H26N4O/c1-3-8-18-16(21)13(2)19-9-11-20(12-10-19)15-6-4-14(17)5-7-15/h4-7,13H,3,8-12,17H2,1-2H3,(H,18,21)/p+1/t13-/m0/s1