dimethyl 2-[(E)-5-chloranylpent-4-enyl]-5-methyl-1-phenyl-pyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[(E)-5-chloranylpent-4-enyl]-5-methyl-1-phenyl-pyrrole-3,4-dicarboxylate Openeye Name: dimethyl 2-[(E)-5-chloropent-4-enyl]-5-methyl-1-phenyl-pyrrole-3,4-dicarboxylate CAS Name: 2-[(E)-5-chloropent-4-enyl]-5-methyl-1-phenylpyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-5-chloropent-4-enyl]-5-methyl-1-phenylpyrrole-3,4-dicarboxylate Traditional Name: 2-[(E)-5-chloropent-4-enyl]-5-methyl-1-phenyl-pyrrole-3,4-dicarboxylic acid dimethyl ester Formula: C20H22ClNO4 MolecularWeight: 375.84598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C2=CC=CC=C2)CCCC=CCl)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1C2=CC=CC=C2)CCC/C=C/Cl)C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H22ClNO4/c1-14-17(19(23)25-2)18(20(24)26-3)16(12-8-5-9-13-21)22(14)15-10-6-4-7-11-15/h4,6-7,9-11,13H,5,8,12H2,1-3H3/b13-9+