methyl 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-pyridin-4-yl-pyrrole-2-carboxylate

Systemtic Name: methyl 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-pyridin-4-yl-pyrrole-2-carboxylate Openeye Name: methyl 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-(4-pyridyl)pyrrole-2-carboxylate CAS Name: 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-pyridin-4-yl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrrole-2-carboxylate Traditional Name: 5-(3-acetamidophenyl)-3-(4-fluorophenyl)-1-methyl-4-(4-pyridyl)pyrrole-2-carboxylic acid methyl ester Formula: C26H22FN3O3 MolecularWeight: 443.469583

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=C(C(=C(N2C)C(=O)OC)C3=CC=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=C(C(=C(N2C)C(=O)OC)C3=CC=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C26H22FN3O3/c1-16(31)29-21-6-4-5-19(15-21)24-22(18-11-13-28-14-12-18)23(17-7-9-20(27)10-8-17)25(30(24)2)26(32)33-3/h4-15H,1-3H3,(H,29,31)