2,9-bis(4-methylcyclohexa-2,4-dien-1-yl)-4,7-diphenyl-1,10-phenanthroline

Systemtic Name: 2,9-bis(4-methylcyclohexa-2,4-dien-1-yl)-4,7-diphenyl-1,10-phenanthroline Openeye Name: 2,9-bis(4-methylcyclohexa-2,4-dien-1-yl)-4,7-diphenyl-1,10-phenanthroline CAS Name: 2,9-bis(4-methyl-1-cyclohexa-2,4-dienyl)-4,7-diphenyl-1,10-phenanthroline IUPAC Name: 2,9-bis(4-methylcyclohexa-2,4-dien-1-yl)-4,7-diphenyl-1,10-phenanthroline Traditional Name: 2,9-bis(4-methylcyclohexa-2,4-dien-1-yl)-4,7-diphenyl-1,10-phenanthroline Formula: C38H32N2 MolecularWeight: 516.67408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C=C1)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6CC=C(C=C6)C)C(=C2)C7=CC=CC=C7

Isomeric SMILES

CC1=CCC(C=C1)C2=NC3=C(C=CC4=C3N=C(C=C4C5=CC=CC=C5)C6CC=C(C=C6)C)C(=C2)C7=CC=CC=C7

InChI

InChI=1S/C38H32N2/c1-25-13-17-29(18-14-25)35-23-33(27-9-5-3-6-10-27)31-21-22-32-34(28-11-7-4-8-12-28)24-36(40-38(32)37(31)39-35)30-19-15-26(2)16-20-30/h3-17,19,21-24,29-30H,18,20H2,1-2H3