(phenylmethyl) 5-methanoyl-3,4-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-methanoyl-3,4-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-formyl-3,4-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 5-formyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-formyl-3,4-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 5-formyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)C=O

Isomeric SMILES

CC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)C=O

InChI

InChI=1S/C15H15NO3/c1-10-11(2)14(16-13(10)8-17)15(18)19-9-12-6-4-3-5-7-12/h3-8,16H,9H2,1-2H3