4-(3-phenylpropanoyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3-phenylpropanoyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3-phenylpropanoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(1-oxo-3-phenylpropyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3-phenylpropanoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-hydrocinnamoyl-1H-pyrrole-2-carboxylic acid Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C14H13NO3/c16-13(7-6-10-4-2-1-3-5-10)11-8-12(14(17)18)15-9-11/h1-5,8-9,15H,6-7H2,(H,17,18)