3-phenylpropyl N-(5-tert-butyl-2-oxidanyl-phenyl)carbamate

Systemtic Name: 3-phenylpropyl N-(5-tert-butyl-2-oxidanyl-phenyl)carbamate Openeye Name: 3-phenylpropyl N-(5-tert-butyl-2-hydroxy-phenyl)carbamate CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)carbamic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl N-(5-tert-butyl-2-hydroxyphenyl)carbamate Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)carbamic acid 3-phenylpropyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C20H25NO3/c1-20(2,3)16-11-12-18(22)17(14-16)21-19(23)24-13-7-10-15-8-5-4-6-9-15/h4-6,8-9,11-12,14,22H,7,10,13H2,1-3H3,(H,21,23)