N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]but-3-enamide

Systemtic Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]but-3-enamide Openeye Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]but-3-enamide CAS Name: N-[(3S)-1-[(4-chlorophenyl)methyl]-3-piperidin-1-iumyl]-3-butenamide IUPAC Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]but-3-enamide Traditional Name: N-[(3S)-1-(4-chlorobenzyl)piperidin-1-ium-3-yl]but-3-enamide Formula: C16H22ClN2O+ MolecularWeight: 293.81168

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=O)NC1CCC[NH+](C1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCC(=O)N[C@H]1CCC[NH+](C1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H21ClN2O/c1-2-4-16(20)18-15-5-3-10-19(12-15)11-13-6-8-14(17)9-7-13/h2,6-9,15H,1,3-5,10-12H2,(H,18,20)/p+1/t15-/m0/s1