(phenylmethyl) 5-(acetyloxymethyl)-3-methyl-4-(phenylcarbonyl)-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-(acetyloxymethyl)-3-methyl-4-(phenylcarbonyl)-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-(acetoxymethyl)-4-benzoyl-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-(acetyloxymethyl)-4-benzoyl-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(acetyloxymethyl)-4-benzoyl-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-(acetoxymethyl)-4-benzoyl-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C2=CC=CC=C2)COC(=O)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C2=CC=CC=C2)COC(=O)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21NO5/c1-15-20(22(26)18-11-7-4-8-12-18)19(14-28-16(2)25)24-21(15)23(27)29-13-17-9-5-3-6-10-17/h3-12,24H,13-14H2,1-2H3