(2S)-N-[(4-chlorophenyl)methyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]propanamide IUPAC Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(4-chlorobenzyl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]propionamide Formula: C18H22ClN2OS+ MolecularWeight: 349.89808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)Cl)[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)Cl)[NH+]2CCC[C@@H]2C3=CC=CS3

InChI

InChI=1S/C18H21ClN2OS/c1-13(18(22)20-12-14-6-8-15(19)9-7-14)21-10-2-4-16(21)17-5-3-11-23-17/h3,5-9,11,13,16H,2,4,10,12H2,1H3,(H,20,22)/p+1/t13-,16+/m0/s1