N-(4-piperazin-4-ium-1-ylphenyl)propanamide

Systemtic Name: N-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-(4-piperazin-4-ium-1-ylphenyl)propionamide Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)N2CC[NH2+]CC2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)N2CC[NH2+]CC2

InChI

InChI=1S/C13H19N3O/c1-2-13(17)15-11-3-5-12(6-4-11)16-9-7-14-8-10-16/h3-6,14H,2,7-10H2,1H3,(H,15,17)/p+1