(4-tert-butylphenyl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (4-tert-butylphenyl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (4-tert-butylphenyl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (4-tert-butylbenzyl) ester Formula: C22H25NO3 MolecularWeight: 351.4388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C22H25NO3/c1-22(2,3)18-10-6-16(7-11-18)15-26-21(25)17-8-12-19(13-9-17)23-14-4-5-20(23)24/h6-13H,4-5,14-15H2,1-3H3