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

Systemtic Name: N-tert-butyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Openeye Name: N-tert-butyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide CAS Name: N-tert-butyl-3-[4-(1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: N-tert-butyl-3-(4-piperazin-4-ium-1-ylphenyl)propanamide Traditional Name: N-tert-butyl-3-(4-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=C(C=C1)N2CC[NH2+]CC2

Isomeric SMILES

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

InChI

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