(3-chlorophenyl)-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: (3-chlorophenyl)-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(3-chlorophenyl)methanone CAS Name: (3-chlorophenyl)-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(3-chlorophenyl)methanone Traditional Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(3-chlorophenyl)methanone Formula: C19H21ClNO+ MolecularWeight: 314.82914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClNO/c20-18-10-4-8-16(12-18)19(22)17-9-5-11-21(14-17)13-15-6-2-1-3-7-15/h1-4,6-8,10,12,17H,5,9,11,13-14H2/p+1/t17-/m0/s1