1-phenyl-4-[(3S)-1-(phenylmethyl)piperidin-3-yl]piperazin-4-ium

Systemtic Name: 1-phenyl-4-[(3S)-1-(phenylmethyl)piperidin-3-yl]piperazin-4-ium Openeye Name: 1-[(3S)-1-benzyl-3-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-phenyl-4-[(3S)-1-(phenylmethyl)-3-piperidinyl]piperazin-4-ium IUPAC Name: 1-[(3S)-1-benzylpiperidin-3-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(3S)-1-benzyl-3-piperidyl]-4-phenyl-piperazin-1-ium Formula: C22H30N3+ MolecularWeight: 336.4937

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H29N3/c1-3-8-20(9-4-1)18-23-13-7-12-22(19-23)25-16-14-24(15-17-25)21-10-5-2-6-11-21/h1-6,8-11,22H,7,12-19H2/p+1/t22-/m0/s1