(4-cyanophenyl)methyl 4-methyl-3-pyrrol-1-yl-benzoate

Systemtic Name: (4-cyanophenyl)methyl 4-methyl-3-pyrrol-1-yl-benzoate Openeye Name: (4-cyanophenyl)methyl 4-methyl-3-pyrrol-1-yl-benzoate CAS Name: 4-methyl-3-(1-pyrrolyl)benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-methyl-3-pyrrol-1-ylbenzoate Traditional Name: 4-methyl-3-pyrrol-1-yl-benzoic acid (4-cyanobenzyl) ester Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)C#N)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)C#N)N3C=CC=C3

InChI

InChI=1S/C20H16N2O2/c1-15-4-9-18(12-19(15)22-10-2-3-11-22)20(23)24-14-17-7-5-16(13-21)6-8-17/h2-12H,14H2,1H3