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

Systemtic Name: N-pentyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-pentyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-pentyl-3-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-pentyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-amyl-3-(4-piperazin-4-ium-1-ylphenyl)propionamide Formula: C18H30N3O+ MolecularWeight: 304.4503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O/c1-2-3-4-11-20-18(22)10-7-16-5-8-17(9-6-16)21-14-12-19-13-15-21/h5-6,8-9,19H,2-4,7,10-15H2,1H3,(H,20,22)/p+1