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

Systemtic Name: (4-chlorophenyl)-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(4-chlorophenyl)methanone CAS Name: (4-chlorophenyl)-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(4-chlorophenyl)methanone Traditional Name: [(3S)-1-benzylpiperidin-1-ium-3-yl]-(4-chlorophenyl)methanone Formula: C19H21ClNO+ MolecularWeight: 314.82914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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