tert-butyl 2-phenylazepane-1-carboxylate

Systemtic Name: tert-butyl 2-phenylazepane-1-carboxylate Openeye Name: tert-butyl 2-phenylazepane-1-carboxylate CAS Name: 2-phenyl-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-phenylazepane-1-carboxylate Traditional Name: 2-phenylazepane-1-carboxylic acid tert-butyl ester Formula: C17H25NO2 MolecularWeight: 275.3859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCCC1C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCCC1C2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-17(2,3)20-16(19)18-13-9-5-8-12-15(18)14-10-6-4-7-11-14/h4,6-7,10-11,15H,5,8-9,12-13H2,1-3H3