N-tert-butyl-3-(2-piperazin-4-ium-1-ylphenyl)propanamide

Systemtic Name: N-tert-butyl-3-(2-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-tert-butyl-3-(2-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-tert-butyl-3-[2-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-tert-butyl-3-(2-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-tert-butyl-3-(2-piperazin-4-ium-1-ylphenyl)propionamide Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CCC1=CC=CC=C1N2CC[NH2+]CC2

Isomeric SMILES

CC(C)(C)NC(=O)CCC1=CC=CC=C1N2CC[NH2+]CC2

InChI

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