(2,6-ditritiophenyl)-[3-(7-piperidin-1-ylheptoxy)-2-tritio-phenyl]methanone

Systemtic Name: (2,6-ditritiophenyl)-[3-(7-piperidin-1-ylheptoxy)-2-tritio-phenyl]methanone Openeye Name: (2,6-ditritiophenyl)-[3-[7-(1-piperidyl)heptoxy]-2-tritio-phenyl]methanone CAS Name: (2,6-ditritiophenyl)-[3-[7-(1-piperidinyl)heptoxy]-2-tritiophenyl]methanone IUPAC Name: (2,6-ditritiophenyl)-[3-(7-piperidin-1-ylheptoxy)-2-tritiophenyl]methanone Traditional Name: (2,6-ditritiophenyl)-[3-(7-piperidinoheptoxy)-2-tritio-phenyl]methanone Formula: C25H33NO2 MolecularWeight: 385.559348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCCCOC2=CC=CC(=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

[3H]C1=C(C(=CC=C1)[3H])C(=O)C2=C(C(=CC=C2)OCCCCCCCN3CCCCC3)[3H]

InChI

InChI=1S/C25H33NO2/c27-25(22-13-6-4-7-14-22)23-15-12-16-24(21-23)28-20-11-3-1-2-8-17-26-18-9-5-10-19-26/h4,6-7,12-16,21H,1-3,5,8-11,17-20H2/i13T,14T,21T