dimethyl 4-(4-methylphenyl)-1,10-phenanthroline-2,9-dicarboxylate

Systemtic Name: dimethyl 4-(4-methylphenyl)-1,10-phenanthroline-2,9-dicarboxylate Openeye Name: dimethyl 4-(p-tolyl)-1,10-phenanthroline-2,9-dicarboxylate CAS Name: 4-(4-methylphenyl)-1,10-phenanthroline-2,9-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(4-methylphenyl)-1,10-phenanthroline-2,9-dicarboxylate Traditional Name: 4-(p-tolyl)-1,10-phenanthroline-2,9-dicarboxylic acid dimethyl ester Formula: C23H18N2O4 MolecularWeight: 386.40002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N2O4/c1-13-4-6-14(7-5-13)17-12-19(23(27)29-3)25-21-16(17)10-8-15-9-11-18(22(26)28-2)24-20(15)21/h4-12H,1-3H3