4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenyl-phenyl)-1,10-phenanthroline

Systemtic Name: 4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenyl-phenyl)-1,10-phenanthroline Openeye Name: 4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenyl-phenyl)-1,10-phenanthroline CAS Name: 4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenylphenyl)-1,10-phenanthroline IUPAC Name: 4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenylphenyl)-1,10-phenanthroline Traditional Name: 4,7-diphenyl-2,9-bis(2,3,5-trimethyl-6-phenyl-phenyl)-1,10-phenanthroline Formula: C54H44N2 MolecularWeight: 720.94056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2=CC=CC=C2)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C7=C(C(=CC(=C7C)C)C)C8=CC=CC=C8)C(=C3)C9=CC=CC=C9)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C2=CC=CC=C2)C3=NC4=C(C=CC5=C4N=C(C=C5C6=CC=CC=C6)C7=C(C(=CC(=C7C)C)C)C8=CC=CC=C8)C(=C3)C9=CC=CC=C9)C)C

InChI

InChI=1S/C54H44N2/c1-33-29-35(3)49(41-23-15-9-16-24-41)51(37(33)5)47-31-45(39-19-11-7-12-20-39)43-27-28-44-46(40-21-13-8-14-22-40)32-48(56-54(44)53(43)55-47)52-38(6)34(2)30-36(4)50(52)42-25-17-10-18-26-42/h7-32H,1-6H3