[2-aminocarbonyl-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate

Systemtic Name: [2-aminocarbonyl-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate Openeye Name: [2-carbamoyl-5-(3-thienylmethoxy)phenyl] 4-(o-tolyl)butaneperoxoate CAS Name: 4-(2-methylphenyl)butaneperoxoic acid [2-carbamoyl-5-(3-thiophenylmethoxy)phenyl] ester IUPAC Name: [2-carbamoyl-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate Traditional Name: 4-(o-tolyl)peroxybutyric acid [2-carbamoyl-5-(3-thenyloxy)phenyl] ester Formula: C23H23NO5S MolecularWeight: 425.49742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCCC(=O)OOC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1CCCC(=O)OOC2=C(C=CC(=C2)OCC3=CSC=C3)C(=O)N

InChI

InChI=1S/C23H23NO5S/c1-16-5-2-3-6-18(16)7-4-8-22(25)29-28-21-13-19(9-10-20(21)23(24)26)27-14-17-11-12-30-15-17/h2-3,5-6,9-13,15H,4,7-8,14H2,1H3,(H2,24,26)