(N,N'-dicyclohexylcarbamimidoyl) pyridine-2-carboxylate

Systemtic Name: (N,N'-dicyclohexylcarbamimidoyl) pyridine-2-carboxylate Openeye Name: (N,N'-dicyclohexylcarbamimidoyl) pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester IUPAC Name: (N,N'-dicyclohexylcarbamimidoyl) pyridine-2-carboxylate Traditional Name: picolinic acid (N,N'-dicyclohexylamidino) ester Formula: C19H27N3O2 MolecularWeight: 329.43658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)C3=CC=CC=N3

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)C3=CC=CC=N3

InChI

InChI=1S/C19H27N3O2/c23-18(17-13-7-8-14-20-17)24-19(21-15-9-3-1-4-10-15)22-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2,(H,21,22)