2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(1-cyclohexylethyl)-4,7-diphenyl-1,10-phenanthroline Formula: C40H44N2 MolecularWeight: 552.79076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C(C)C6CCCCC6)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC(C1CCCCC1)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C(C)C6CCCCC6)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C40H44N2/c1-27(29-15-7-3-8-16-29)37-25-35(31-19-11-5-12-20-31)33-23-24-34-36(32-21-13-6-14-22-32)26-38(42-40(34)39(33)41-37)28(2)30-17-9-4-10-18-30/h5-6,11-14,19-30H,3-4,7-10,15-18H2,1-2H3