1-[3-(1,1-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)propyl]-4-phenyl-piperidin-4-ol

Systemtic Name: 1-[3-(1,1-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)propyl]-4-phenyl-piperidin-4-ol Openeye Name: 1-[3-(1,1-diphenyltetrazol-1-ium-5-yl)propyl]-4-phenyl-piperidin-4-ol CAS Name: 1-[3-(1,1-diphenyl-5-tetrazol-1-iumyl)propyl]-4-phenyl-4-piperidinol IUPAC Name: 1-[3-(1,1-diphenyltetrazol-1-ium-5-yl)propyl]-4-phenylpiperidin-4-ol Traditional Name: 1-[3-(1,1-diphenyltetrazol-1-ium-5-yl)propyl]-4-phenyl-piperidin-4-ol Formula: C27H30N5O+ MolecularWeight: 440.56

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)O)CCCC3=NN=N[N+]3(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)O)CCCC3=NN=N[N+]3(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H30N5O/c33-27(23-11-4-1-5-12-23)18-21-31(22-19-27)20-10-17-26-28-29-30-32(26,24-13-6-2-7-14-24)25-15-8-3-9-16-25/h1-9,11-16,33H,10,17-22H2/q+1