CHEBI:108020 - 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester ChEBI ID CHEBI:108020 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H16ClNO3 Net Charge 0 Average Mass 317.767 Monoisotopic Mass 317.08187 InChI InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)8-7-12-5-4-6-13(18)9-12/h4-9,19H,1-3H3 InChIKey SSVIORHZXIQVDF-UHFFFAOYSA-N SMILES CC1=C(NC(=C1C(=O)OC)C)C(=O)C=CC2=CC(=CC=C2)Cl ChEBI Ontology Outgoing 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester (CHEBI:108020) has functional parent cinnamic acid (CHEBI:27386) 5-[3-(3-chlorophenyl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester (CHEBI:108020) is a olefinic compound (CHEBI:78840) Manual Xref Database LSM-19397 LINCS View more database links