diethyl 2-(3-ethoxycarbonyl-2,5-dimethyl-4-phenyl-pyrrol-1-yl)propanedioate

Systemtic Name: diethyl 2-(3-ethoxycarbonyl-2,5-dimethyl-4-phenyl-pyrrol-1-yl)propanedioate Openeye Name: diethyl 2-(3-ethoxycarbonyl-2,5-dimethyl-4-phenyl-pyrrol-1-yl)propanedioate CAS Name: 2-(3-ethoxycarbonyl-2,5-dimethyl-4-phenyl-1-pyrrolyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-ethoxycarbonyl-2,5-dimethyl-4-phenylpyrrol-1-yl)propanedioate Traditional Name: 2-(3-carbethoxy-2,5-dimethyl-4-phenyl-pyrrol-1-yl)malonic acid diethyl ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=CC=C2)C)C(C(=O)OCC)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=CC=C2)C)C(C(=O)OCC)C(=O)OCC)C

InChI

InChI=1S/C22H27NO6/c1-6-27-20(24)18-15(5)23(14(4)17(18)16-12-10-9-11-13-16)19(21(25)28-7-2)22(26)29-8-3/h9-13,19H,6-8H2,1-5H3