(3-fluoranyl-4-methoxy-phenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C22H22FNO3 MolecularWeight: 367.413383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OCC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OCC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C22H22FNO3/c1-14-5-8-18(9-6-14)24-15(2)11-19(16(24)3)22(25)27-13-17-7-10-21(26-4)20(23)12-17/h5-12H,13H2,1-4H3