[4-(2,5-dimethylpyrrol-1-yl)phenyl] benzoate

Systemtic Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] benzoate Openeye Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] benzoate CAS Name: benzoic acid [4-(2,5-dimethyl-1-pyrrolyl)phenyl] ester IUPAC Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] benzoate Traditional Name: benzoic acid [4-(2,5-dimethylpyrrol-1-yl)phenyl] ester Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H17NO2/c1-14-8-9-15(2)20(14)17-10-12-18(13-11-17)22-19(21)16-6-4-3-5-7-16/h3-13H,1-2H3