(4-phenylphenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (4-phenylphenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (4-phenylphenyl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (4-phenylbenzyl) ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H19NO3/c1-15(23)19-12-20(22(2)13-19)21(24)25-14-16-8-10-18(11-9-16)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3