ethyl 4-[2-(4-cyanophenoxy)ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-(4-cyanophenoxy)ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(4-cyanophenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-(4-cyanophenoxy)-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-cyanophenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(4-cyanophenoxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC2=CC=C(C=C2)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC2=CC=C(C=C2)C#N)C)C

InChI

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