1-[(3S)-1-(2,2-diphenylethyl)piperidin-1-ium-3-yl]-4-phenyl-piperazine

Systemtic Name: 1-[(3S)-1-(2,2-diphenylethyl)piperidin-1-ium-3-yl]-4-phenyl-piperazine Openeye Name: 1-[(3S)-1-(2,2-diphenylethyl)piperidin-1-ium-3-yl]-4-phenyl-piperazine CAS Name: 1-[(3S)-1-(2,2-diphenylethyl)-3-piperidin-1-iumyl]-4-phenylpiperazine IUPAC Name: 1-[(3S)-1-(2,2-diphenylethyl)piperidin-1-ium-3-yl]-4-phenylpiperazine Traditional Name: 1-[(3S)-1-(2,2-diphenylethyl)piperidin-1-ium-3-yl]-4-phenyl-piperazine Formula: C29H36N3+ MolecularWeight: 426.61624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(C2=CC=CC=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC(C2=CC=CC=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H35N3/c1-4-11-25(12-5-1)29(26-13-6-2-7-14-26)24-30-18-10-17-28(23-30)32-21-19-31(20-22-32)27-15-8-3-9-16-27/h1-9,11-16,28-29H,10,17-24H2/p+1/t28-/m0/s1