3-phenyl-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: 3-phenyl-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-3-phenyl-propanamide CAS Name: 3-phenyl-N-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-3-phenylpropanamide Traditional Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-3-phenyl-propionamide Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O/c24-21(14-13-18-8-3-1-4-9-18)22-20-12-7-15-23(17-20)16-19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,22,24)/p+1/t20-/m0/s1