(4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(4-phenylphenyl)carbonylamino]ethanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-[(4-phenylphenyl)carbonylamino]ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-[(4-phenylbenzoyl)amino]acetate CAS Name: 2-[[oxo-(4-phenylphenyl)methyl]amino]acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-[(4-phenylbenzoyl)amino]acetate Traditional Name: 2-[(4-phenylbenzoyl)amino]acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C23H21NO4S MolecularWeight: 407.48214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C23H21NO4S/c25-20(21-9-5-15-29-21)8-4-14-28-22(26)16-24-23(27)19-12-10-18(11-13-19)17-6-2-1-3-7-17/h1-3,5-7,9-13,15H,4,8,14,16H2,(H,24,27)