methyl 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylate CAS Name: 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[4-[4-(4-cyanophenyl)phenoxy]butyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC=C1CCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)C1=CNC=C1CCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H22N2O3/c1-27-23(26)22-16-25-15-20(22)4-2-3-13-28-21-11-9-19(10-12-21)18-7-5-17(14-24)6-8-18/h5-12,15-16,25H,2-4,13H2,1H3