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

Systemtic Name: diethyl 2-[[[1,5-dimethyl-4-(phenylcarbonyl)pyrrol-3-yl]-methyl-amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-benzoyl-1,5-dimethyl-pyrrol-3-yl)-methyl-amino]methylene]propanedioate CAS Name: 2-[[(4-benzoyl-1,5-dimethyl-3-pyrrolyl)-methylamino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-benzoyl-1,5-dimethylpyrrol-3-yl)-methylamino]methylidene]propanedioate Traditional Name: 2-[[(4-benzoyl-1,5-dimethyl-pyrrol-3-yl)-methyl-amino]methylene]malonic acid diethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN(C)C1=CN(C(=C1C(=O)C2=CC=CC=C2)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CN(C)C1=CN(C(=C1C(=O)C2=CC=CC=C2)C)C)C(=O)OCC

InChI

InChI=1S/C22H26N2O5/c1-6-28-21(26)17(22(27)29-7-2)13-24(5)18-14-23(4)15(3)19(18)20(25)16-11-9-8-10-12-16/h8-14H,6-7H2,1-5H3