2,9-bis(4-ethyl-2,6-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis(4-ethyl-2,6-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(4-ethyl-2,6-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(4-ethyl-2,6-dimethylphenyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(4-ethyl-2,6-dimethylphenyl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(4-ethyl-2,6-dimethyl-phenyl)-4,7-diphenyl-1,10-phenanthroline Formula: C44H40N2 MolecularWeight: 596.8018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C(C=C(C=C6C)CC)C)C(=C2)C7=CC=CC=C7)C

Isomeric SMILES

CCC1=CC(=C(C(=C1)C)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6=C(C=C(C=C6C)CC)C)C(=C2)C7=CC=CC=C7)C

InChI

InChI=1S/C44H40N2/c1-7-31-21-27(3)41(28(4)22-31)39-25-37(33-15-11-9-12-16-33)35-19-20-36-38(34-17-13-10-14-18-34)26-40(46-44(36)43(35)45-39)42-29(5)23-32(8-2)24-30(42)6/h9-26H,7-8H2,1-6H3