2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)C[NH+]1CCCC1C2=CC=CC=C2

Isomeric SMILES

C=CCNC(=O)NC(=O)C[NH+]1CCC[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2/c1-2-10-17-16(21)18-15(20)12-19-11-6-9-14(19)13-7-4-3-5-8-13/h2-5,7-8,14H,1,6,9-12H2,(H2,17,18,20,21)/p+1/t14-/m0/s1