(2S)-2-phenyl-N-(phenylmethyl)-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: (2S)-2-phenyl-N-(phenylmethyl)-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: (2S)-N-benzyl-2-phenyl-2-piperidin-1-ium-1-yl-ethanamine CAS Name: (2S)-2-phenyl-N-(phenylmethyl)-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: (2S)-N-benzyl-2-phenyl-2-piperidin-1-ium-1-ylethanamine Traditional Name: benzyl-[(2S)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]amine Formula: C20H27N2+ MolecularWeight: 295.44178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)[C@H](CNCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2/c1-4-10-18(11-5-1)16-21-17-20(19-12-6-2-7-13-19)22-14-8-3-9-15-22/h1-2,4-7,10-13,20-21H,3,8-9,14-17H2/p+1/t20-/m1/s1