[1-(3-tert-butyl-4-oxidanyl-phenyl)-3-(phenylmethoxycarbonylamino)propan-2-yl]carbamic acid

Systemtic Name: [1-(3-tert-butyl-4-oxidanyl-phenyl)-3-(phenylmethoxycarbonylamino)propan-2-yl]carbamic acid Openeye Name: [1-(benzyloxycarbonylaminomethyl)-2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]carbamic acid CAS Name: [1-(3-tert-butyl-4-hydroxyphenyl)-3-(phenylmethoxycarbonylamino)propan-2-yl]carbamic acid IUPAC Name: [1-(3-tert-butyl-4-hydroxyphenyl)-3-(phenylmethoxycarbonylamino)propan-2-yl]carbamic acid Traditional Name: [1-(benzyloxycarbonylaminomethyl)-2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]carbamic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)CC(CNC(=O)OCC2=CC=CC=C2)NC(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)CC(CNC(=O)OCC2=CC=CC=C2)NC(=O)O)O

InChI

InChI=1S/C22H28N2O5/c1-22(2,3)18-12-16(9-10-19(18)25)11-17(24-20(26)27)13-23-21(28)29-14-15-7-5-4-6-8-15/h4-10,12,17,24-25H,11,13-14H2,1-3H3,(H,23,28)(H,26,27)