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

Systemtic Name: diethyl 2-[[[1,5-dimethyl-4-(phenylcarbonyl)pyrrol-3-yl]amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(4-benzoyl-1,5-dimethyl-pyrrol-3-yl)amino]methylene]propanedioate CAS Name: 2-[[(4-benzoyl-1,5-dimethyl-3-pyrrolyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(4-benzoyl-1,5-dimethylpyrrol-3-yl)amino]methylidene]propanedioate Traditional Name: 2-[[(4-benzoyl-1,5-dimethyl-pyrrol-3-yl)amino]methylene]malonic acid diethyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CN(C(=C1C(=O)C2=CC=CC=C2)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CN(C(=C1C(=O)C2=CC=CC=C2)C)C)C(=O)OCC

InChI

InChI=1S/C21H24N2O5/c1-5-27-20(25)16(21(26)28-6-2)12-22-17-13-23(4)14(3)18(17)19(24)15-10-8-7-9-11-15/h7-13,22H,5-6H2,1-4H3