(2S)-N-(4-tert-butylphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(4-tert-butylphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(4-tert-butylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(4-tert-butylphenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(4-tert-butylphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(4-tert-butylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CCC[NH2+]2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)[C@@H]2CCC[NH2+]2

InChI

InChI=1S/C15H22N2O/c1-15(2,3)11-6-8-12(9-7-11)17-14(18)13-5-4-10-16-13/h6-9,13,16H,4-5,10H2,1-3H3,(H,17,18)/p+1/t13-/m0/s1