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

Systemtic Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] 4-methylbenzoate Openeye Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-(2,5-dimethyl-1-pyrrolyl)phenyl] ester IUPAC Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(2,5-dimethylpyrrol-1-yl)phenyl] ester Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)N3C(=CC=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)N3C(=CC=C3C)C

InChI

InChI=1S/C20H19NO2/c1-14-4-8-17(9-5-14)20(22)23-19-12-10-18(11-13-19)21-15(2)6-7-16(21)3/h4-13H,1-3H3