N-tert-butyl-3-(3-piperazin-4-ium-1-ylphenyl)propanamide

Systemtic Name: N-tert-butyl-3-(3-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-tert-butyl-3-(3-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-tert-butyl-3-[3-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-tert-butyl-3-(3-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-tert-butyl-3-(3-piperazin-4-ium-1-ylphenyl)propionamide Formula: C17H28N3O+ MolecularWeight: 290.42372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O/c1-17(2,3)19-16(21)8-7-14-5-4-6-15(13-14)20-11-9-18-10-12-20/h4-6,13,18H,7-12H2,1-3H3,(H,19,21)/p+1