N-(2,6-diethylphenyl)-2-[(2S)-2-(phenylmethyl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[(2S)-2-(phenylmethyl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: 2-[(2S)-2-benzylpyrrolidin-1-ium-1-yl]-N-(2,6-diethylphenyl)acetamide CAS Name: N-(2,6-diethylphenyl)-2-[(2S)-2-(phenylmethyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[(2S)-2-benzylpyrrolidin-1-ium-1-yl]-N-(2,6-diethylphenyl)acetamide Traditional Name: 2-[(2S)-2-benzylpyrrolidin-1-ium-1-yl]-N-(2,6-diethylphenyl)acetamide Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCCC2CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C[NH+]2CCC[C@H]2CC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O/c1-3-19-12-8-13-20(4-2)23(19)24-22(26)17-25-15-9-14-21(25)16-18-10-6-5-7-11-18/h5-8,10-13,21H,3-4,9,14-17H2,1-2H3,(H,24,26)/p+1/t21-/m0/s1