2-[4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)phenoxy]propanoic acid

Systemtic Name: 2-[4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)phenoxy]propanoic acid Openeye Name: 2-[4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)phenoxy]propanoic acid CAS Name: 2-[4-(3-formyl-2,5-dimethyl-1-pyrrolyl)phenoxy]propanoic acid IUPAC Name: 2-[4-(3-formyl-2,5-dimethylpyrrol-1-yl)phenoxy]propanoic acid Traditional Name: 2-[4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)phenoxy]propionic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO4/c1-10-8-13(9-18)11(2)17(10)14-4-6-15(7-5-14)21-12(3)16(19)20/h4-9,12H,1-3H3,(H,19,20)