N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-3-thiophen-3-yl-propanamide

Systemtic Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-3-thiophen-3-yl-propanamide Openeye Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-3-(3-thienyl)propanamide CAS Name: N-[(3S)-1-[(4-chlorophenyl)methyl]-3-piperidin-1-iumyl]-3-(3-thiophenyl)propanamide IUPAC Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-3-thiophen-3-ylpropanamide Traditional Name: N-[(3S)-1-(4-chlorobenzyl)piperidin-1-ium-3-yl]-3-(3-thienyl)propionamide Formula: C19H24ClN2OS+ MolecularWeight: 363.92466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)Cl)NC(=O)CCC3=CSC=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)Cl)NC(=O)CCC3=CSC=C3

InChI

InChI=1S/C19H23ClN2OS/c20-17-6-3-15(4-7-17)12-22-10-1-2-18(13-22)21-19(23)8-5-16-9-11-24-14-16/h3-4,6-7,9,11,14,18H,1-2,5,8,10,12-13H2,(H,21,23)/p+1/t18-/m0/s1