2,9-bis(bromomethyl)-4-(4-methylphenyl)-1,10-phenanthroline

Systemtic Name: 2,9-bis(bromomethyl)-4-(4-methylphenyl)-1,10-phenanthroline Openeye Name: 2,9-bis(bromomethyl)-4-(p-tolyl)-1,10-phenanthroline CAS Name: 2,9-bis(bromomethyl)-4-(4-methylphenyl)-1,10-phenanthroline IUPAC Name: 2,9-bis(bromomethyl)-4-(4-methylphenyl)-1,10-phenanthroline Traditional Name: 2,9-bis(bromomethyl)-4-(p-tolyl)-1,10-phenanthroline Formula: C21H16Br2N2 MolecularWeight: 456.17314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4)CBr)CBr

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4)CBr)CBr

InChI

InChI=1S/C21H16Br2N2/c1-13-2-4-14(5-3-13)19-10-17(12-23)25-21-18(19)9-7-15-6-8-16(11-22)24-20(15)21/h2-10H,11-12H2,1H3