[4-(4-bromophenyl)-4-oxidanylidene-butyl] 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate

Systemtic Name: [4-(4-bromophenyl)-4-oxidanylidene-butyl] 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate Openeye Name: [4-(4-bromophenyl)-4-oxo-butyl] 4-[(4-chlorophenyl)methoxy]-3-methoxy-benzoate CAS Name: 4-[(4-chlorophenyl)methoxy]-3-methoxybenzoic acid [4-(4-bromophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-bromophenyl)-4-oxobutyl] 4-[(4-chlorophenyl)methoxy]-3-methoxybenzoate Traditional Name: 4-(4-chlorobenzyl)oxy-3-methoxy-benzoic acid [4-(4-bromophenyl)-4-keto-butyl] ester Formula: C25H22BrClO5 MolecularWeight: 517.79618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)Br)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCCCC(=O)C2=CC=C(C=C2)Br)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H22BrClO5/c1-30-24-15-19(8-13-23(24)32-16-17-4-11-21(27)12-5-17)25(29)31-14-2-3-22(28)18-6-9-20(26)10-7-18/h4-13,15H,2-3,14,16H2,1H3