4-(2-chlorophenyl)-7-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-phenethyl-chromen-2-one

Systemtic Name: 4-(2-chlorophenyl)-7-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-phenethyl-chromen-2-one Openeye Name: 4-(2-chlorophenyl)-7-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-phenethyl-chromen-2-one CAS Name: 4-(2-chlorophenyl)-7-[2-(1-imidazolyl)-1-phenylethoxy]-8-phenethyl-1-benzopyran-2-one IUPAC Name: 4-(2-chlorophenyl)-7-(2-imidazol-1-yl-1-phenylethoxy)-8-phenethylchromen-2-one Traditional Name: 4-(2-chlorophenyl)-7-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-phenethyl-coumarin Formula: C34H27ClN2O3 MolecularWeight: 547.04278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4Cl)OC(CN5C=CN=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C=CC3=C2OC(=O)C=C3C4=CC=CC=C4Cl)OC(CN5C=CN=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H27ClN2O3/c35-30-14-8-7-13-26(30)29-21-33(38)40-34-27(29)17-18-31(28(34)16-15-24-9-3-1-4-10-24)39-32(22-37-20-19-36-23-37)25-11-5-2-6-12-25/h1-14,17-21,23,32H,15-16,22H2