O4-[2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] O1-ethyl but-2-enedioate

Systemtic Name: O4-[2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] O1-ethyl but-2-enedioate Openeye Name: O4-[2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl] O1-ethyl but-2-enedioate CAS Name: 2-butenedioic acid O4-[2-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 1-O-ethyl but-2-enedioate Traditional Name: but-2-enedioic acid O4-[2-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl] ester O1-ethyl ester Formula: C20H20BrNO5 MolecularWeight: 434.2805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C=CC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C20H20BrNO5/c1-4-26-19(24)9-10-20(25)27-12-18(23)17-11-13(2)22(14(17)3)16-7-5-15(21)6-8-16/h5-11H,4,12H2,1-3H3