dimethyl (E)-2-(2-pyrrol-1-ylphenoxy)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(2-pyrrol-1-ylphenoxy)but-2-enedioate Openeye Name: dimethyl (E)-2-(2-pyrrol-1-ylphenoxy)but-2-enedioate CAS Name: (E)-2-[2-(1-pyrrolyl)phenoxy]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(2-pyrrol-1-ylphenoxy)but-2-enedioate Traditional Name: (E)-2-(2-pyrrol-1-ylphenoxy)but-2-enedioic acid dimethyl ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)OC1=CC=CC=C1N2C=CC=C2

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/OC1=CC=CC=C1N2C=CC=C2

InChI

InChI=1S/C16H15NO5/c1-20-15(18)11-14(16(19)21-2)22-13-8-4-3-7-12(13)17-9-5-6-10-17/h3-11H,1-2H3/b14-11+