O2-[(2-cyanophenyl)methyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[(2-cyanophenyl)methyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[(2-cyanophenyl)methyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[(2-cyanophenyl)methyl] ester O4-methyl ester IUPAC Name: 2-O-[(2-cyanophenyl)methyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(2-cyanobenzyl) ester O4-methyl ester Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC2=CC=CC=C2C#N

InChI

InChI=1S/C17H16N2O4/c1-10-14(16(20)22-3)11(2)19-15(10)17(21)23-9-13-7-5-4-6-12(13)8-18/h4-7,19H,9H2,1-3H3