N-methyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide

Systemtic Name: N-methyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-methyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-methyl-3-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-methyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-methyl-3-(4-piperazin-4-ium-1-ylphenyl)propionamide Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1=CC=C(C=C1)N2CC[NH2+]CC2

Isomeric SMILES

CNC(=O)CCC1=CC=C(C=C1)N2CC[NH2+]CC2

InChI

InChI=1S/C14H21N3O/c1-15-14(18)7-4-12-2-5-13(6-3-12)17-10-8-16-9-11-17/h2-3,5-6,16H,4,7-11H2,1H3,(H,15,18)/p+1