4-tert-butyl-N-(4-methylphenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-tert-butyl-N-(4-methylphenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-tert-butyl-N-(p-tolyl)piperazin-4-ium-1-carboxamide CAS Name: 4-tert-butyl-N-(4-methylphenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-tert-butyl-N-(4-methylphenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-tert-butyl-N-(p-tolyl)piperazin-4-ium-1-carboxamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)C(C)(C)C

InChI

InChI=1S/C16H25N3O/c1-13-5-7-14(8-6-13)17-15(20)18-9-11-19(12-10-18)16(2,3)4/h5-8H,9-12H2,1-4H3,(H,17,20)/p+1