4-chloranyl-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline

Systemtic Name: 4-chloranyl-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline Openeye Name: 4-chloro-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline CAS Name: 4-chloro-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline IUPAC Name: 4-chloro-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline Traditional Name: 4-chloro-5,6-dihexoxy-3,8-diphenyl-1,10-phenanthroline Formula: C36H39ClN2O2 MolecularWeight: 567.16006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C2=C(C(=CN=C2C3=NC=C(C=C13)C4=CC=CC=C4)C5=CC=CC=C5)Cl)OCCCCCC

Isomeric SMILES

CCCCCCOC1=C(C2=C(C(=CN=C2C3=NC=C(C=C13)C4=CC=CC=C4)C5=CC=CC=C5)Cl)OCCCCCC

InChI

InChI=1S/C36H39ClN2O2/c1-3-5-7-15-21-40-35-29-23-28(26-17-11-9-12-18-26)24-38-33(29)34-31(36(35)41-22-16-8-6-4-2)32(37)30(25-39-34)27-19-13-10-14-20-27/h9-14,17-20,23-25H,3-8,15-16,21-22H2,1-2H3