1,7-dipyridin-3-ylheptan-4-yl 1-azabicyclo[2.2.1]heptane-3-carboxylate

Systemtic Name: 1,7-dipyridin-3-ylheptan-4-yl 1-azabicyclo[2.2.1]heptane-3-carboxylate Openeye Name: [4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl] 1-azabicyclo[2.2.1]heptane-3-carboxylate CAS Name: 1-azabicyclo[2.2.1]heptane-3-carboxylic acid 1,7-bis(3-pyridinyl)heptan-4-yl ester IUPAC Name: 1,7-dipyridin-3-ylheptan-4-yl 1-azabicyclo[2.2.1]heptane-3-carboxylate Traditional Name: 1-azabicyclo[2.2.1]heptane-3-carboxylic acid [4-(3-pyridyl)-1-[3-(3-pyridyl)propyl]butyl] ester Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CC1C(C2)C(=O)OC(CCCC3=CN=CC=C3)CCCC4=CN=CC=C4

Isomeric SMILES

C1CN2CC1C(C2)C(=O)OC(CCCC3=CN=CC=C3)CCCC4=CN=CC=C4

InChI

InChI=1S/C24H31N3O2/c28-24(23-18-27-14-11-21(23)17-27)29-22(9-1-5-19-7-3-12-25-15-19)10-2-6-20-8-4-13-26-16-20/h3-4,7-8,12-13,15-16,21-23H,1-2,5-6,9-11,14,17-18H2