diethyl 5-[3-(4-chlorophenyl)prop-2-enoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-[3-(4-chlorophenyl)prop-2-enoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[3-(4-chlorophenyl)prop-2-enoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[3-(4-chlorophenyl)-1-oxoprop-2-enoxy]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-(4-chlorophenyl)prop-2-enoyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[3-(4-chlorophenyl)acryloyl]oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C21H22ClNO6 MolecularWeight: 419.85548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)C=CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO6/c1-4-27-20(25)18-13(3)19(21(26)28-5-2)23-16(18)12-29-17(24)11-8-14-6-9-15(22)10-7-14/h6-11,23H,4-5,12H2,1-3H3