methyl 5-phenyl-2-quinolin-2-yl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-phenyl-2-quinolin-2-yl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-phenyl-2-(2-quinolyl)-1H-pyrrole-3-carboxylate CAS Name: 5-phenyl-2-(2-quinolinyl)-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-quinolin-2-yl-1H-pyrrole-3-carboxylate Traditional Name: 5-phenyl-2-(2-quinolyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H16N2O2 MolecularWeight: 328.36394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=C1)C2=CC=CC=C2)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=C(NC(=C1)C2=CC=CC=C2)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16N2O2/c1-25-21(24)16-13-19(14-7-3-2-4-8-14)23-20(16)18-12-11-15-9-5-6-10-17(15)22-18/h2-13,23H,1H3