ethyl 5-[(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-3-(3-chloro-4,5-dimethoxyphenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-3-(3-chloro-4,5-dimethoxy-phenyl)acryloyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)/C=C/C2=CC(=C(C(=C2)Cl)OC)OC)C

InChI

InChI=1S/C20H22ClNO5/c1-6-27-20(24)17-11(2)18(22-12(17)3)15(23)8-7-13-9-14(21)19(26-5)16(10-13)25-4/h7-10,22H,6H2,1-5H3/b8-7+