2-phenylbutyl 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylate

Systemtic Name: 2-phenylbutyl 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylate Openeye Name: 2-phenylbutyl 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylate CAS Name: 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylic acid 2-phenylbutyl ester IUPAC Name: 2-phenylbutyl 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylate Traditional Name: 3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylic acid 2-phenylbutyl ester Formula: C17H21N3O2 MolecularWeight: 299.36754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)N1CCC2=C(C1)NC=N2)C3=CC=CC=C3

Isomeric SMILES

CCC(COC(=O)N1CCC2=C(C1)NC=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2/c1-2-13(14-6-4-3-5-7-14)11-22-17(21)20-9-8-15-16(10-20)19-12-18-15/h3-7,12-13H,2,8-11H2,1H3,(H,18,19)