tert-butyl N-[[3-(2-pyridin-4-ylethylcarbamoyl)phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-(2-pyridin-4-ylethylcarbamoyl)phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-[2-(4-pyridyl)ethylcarbamoyl]phenyl]methyl]carbamate CAS Name: N-[[3-[oxo-(2-pyridin-4-ylethylamino)methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-(2-pyridin-4-ylethylcarbamoyl)phenyl]methyl]carbamate Traditional Name: N-[3-[2-(4-pyridyl)ethylcarbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C(=O)NCCC2=CC=NC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C(=O)NCCC2=CC=NC=C2

InChI

InChI=1S/C20H25N3O3/c1-20(2,3)26-19(25)23-14-16-5-4-6-17(13-16)18(24)22-12-9-15-7-10-21-11-8-15/h4-8,10-11,13H,9,12,14H2,1-3H3,(H,22,24)(H,23,25)