4-tert-butyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 4-tert-butyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Openeye Name: 4-tert-butyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide CAS Name: 4-tert-butyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-tert-butyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Traditional Name: 4-tert-butyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC[NH+]2CCCC2

InChI

InChI=1S/C17H26N2O/c1-17(2,3)15-8-6-14(7-9-15)16(20)18-10-13-19-11-4-5-12-19/h6-9H,4-5,10-13H2,1-3H3,(H,18,20)/p+1