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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OC2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C17H16N2O4/c1-4-22-16(20)14-10(2)15(19-11(14)3)17(21)23-13-7-5-12(9-18)6-8-13/h5-8,19H,4H2,1-3H3