2-[3-(2-phenylethanoyl)pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(2-phenylethanoyl)pyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-(2-phenylacetyl)pyrrol-1-yl]acetic acid CAS Name: 2-[3-(1-oxo-2-phenylethyl)-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-(2-phenylacetyl)pyrrol-1-yl]acetic acid Traditional Name: 2-[3-(2-phenylacetyl)pyrrol-1-yl]acetic acid Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)C2=CN(C=C2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)C2=CN(C=C2)CC(=O)O

InChI

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