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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OC2=CC=C(C=C2)C#N)C

InChI

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