2-(4-chlorophenyl)-4-ethoxycarbonyl-1-(4-methoxyphenyl)-5-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-(4-chlorophenyl)-4-ethoxycarbonyl-1-(4-methoxyphenyl)-5-methyl-pyrrole-3-carboxylic acid Openeye Name: 2-(4-chlorophenyl)-4-ethoxycarbonyl-1-(4-methoxyphenyl)-5-methyl-pyrrole-3-carboxylic acid CAS Name: 2-(4-chlorophenyl)-4-ethoxycarbonyl-1-(4-methoxyphenyl)-5-methyl-3-pyrrolecarboxylic acid IUPAC Name: 2-(4-chlorophenyl)-4-ethoxycarbonyl-1-(4-methoxyphenyl)-5-methylpyrrole-3-carboxylic acid Traditional Name: 4-carbethoxy-2-(4-chlorophenyl)-1-(4-methoxyphenyl)-5-methyl-pyrrole-3-carboxylic acid Formula: C22H20ClNO5 MolecularWeight: 413.8509

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H20ClNO5/c1-4-29-22(27)18-13(2)24(16-9-11-17(28-3)12-10-16)20(19(18)21(25)26)14-5-7-15(23)8-6-14/h5-12H,4H2,1-3H3,(H,25,26)