(4-methylphenyl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: (4-methylphenyl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: p-tolylmethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid (4-methylbenzyl) ester Formula: C21H21NO2 MolecularWeight: 319.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)N3C(=CC=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)N3C(=CC=C3C)C

InChI

InChI=1S/C21H21NO2/c1-15-4-8-18(9-5-15)14-24-21(23)19-10-12-20(13-11-19)22-16(2)6-7-17(22)3/h4-13H,14H2,1-3H3