methyl 11-(4-methoxyphenyl)carbonylpyrrolo[1,2-a][1,10]phenanthroline-9-carboxylate

Systemtic Name: methyl 11-(4-methoxyphenyl)carbonylpyrrolo[1,2-a][1,10]phenanthroline-9-carboxylate Openeye Name: methyl 11-(4-methoxybenzoyl)pyrrolo[1,2-a][1,10]phenanthroline-9-carboxylate CAS Name: 11-[(4-methoxyphenyl)-oxomethyl]-9-pyrrolo[1,2-a][1,10]phenanthrolinecarboxylic acid methyl ester IUPAC Name: methyl 11-(4-methoxybenzoyl)pyrrolo[1,2-a][1,10]phenanthroline-9-carboxylate Traditional Name: 11-p-anisoylpyrrolo[1,2-a][1,10]phenanthroline-9-carboxylic acid methyl ester Formula: C25H18N2O4 MolecularWeight: 410.42142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC(=C3N2C4=C(C=CC5=C4N=CC=C5)C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC(=C3N2C4=C(C=CC5=C4N=CC=C5)C=C3)C(=O)OC

InChI

InChI=1S/C25H18N2O4/c1-30-18-10-7-17(8-11-18)24(28)21-14-19(25(29)31-2)20-12-9-16-6-5-15-4-3-13-26-22(15)23(16)27(20)21/h3-14H,1-2H3