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

Systemtic Name: O2-[(2-cyanophenyl)methyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[(2-cyanophenyl)methyl] O4-ethyl 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-ethyl ester IUPAC Name: 2-O-[(2-cyanophenyl)methyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(2-cyanobenzyl) ester O4-ethyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2C#N)C

InChI

InChI=1S/C18H18N2O4/c1-4-23-17(21)15-11(2)16(20-12(15)3)18(22)24-10-14-8-6-5-7-13(14)9-19/h5-8,20H,4,10H2,1-3H3