[2-oxidanylidene-2-(phenethylamino)ethyl] 4-tert-butylbenzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 4-tert-butylbenzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3/c1-21(2,3)18-11-9-17(10-12-18)20(24)25-15-19(23)22-14-13-16-7-5-4-6-8-16/h4-12H,13-15H2,1-3H3,(H,22,23)