N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]furan-3-carboxamide

Systemtic Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]furan-3-carboxamide Openeye Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]furan-3-carboxamide CAS Name: N-[(3S)-1-[(4-chlorophenyl)methyl]-3-piperidin-1-iumyl]-3-furancarboxamide IUPAC Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]furan-3-carboxamide Traditional Name: N-[(3S)-1-(4-chlorobenzyl)piperidin-1-ium-3-yl]-3-furamide Formula: C17H20ClN2O2+ MolecularWeight: 319.8059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O2/c18-15-5-3-13(4-6-15)10-20-8-1-2-16(11-20)19-17(21)14-7-9-22-12-14/h3-7,9,12,16H,1-2,8,10-11H2,(H,19,21)/p+1/t16-/m0/s1