diethyl 2-[[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]propanedioate CAS Name: 2-[[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]propanedioate Traditional Name: 2-[[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]malonic acid diethyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C(=C1)C)C2=CC=C(C=C2)Br)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(N(C(=C1)C)C2=CC=C(C=C2)Br)C)C(=O)OCC

InChI

InChI=1S/C20H22BrNO4/c1-5-25-19(23)18(20(24)26-6-2)12-15-11-13(3)22(14(15)4)17-9-7-16(21)8-10-17/h7-12H,5-6H2,1-4H3