3-[4-[1-[4-(2-carboxyethyl)phenyl]pyrrol-2-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[1-[4-(2-carboxyethyl)phenyl]pyrrol-2-yl]phenyl]propanoic acid Openeye Name: 3-[4-[1-[4-(2-carboxyethyl)phenyl]pyrrol-2-yl]phenyl]propanoic acid CAS Name: 3-[4-[1-[4-(2-carboxyethyl)phenyl]-2-pyrrolyl]phenyl]propanoic acid IUPAC Name: 3-[4-[1-[4-(2-carboxyethyl)phenyl]pyrrol-2-yl]phenyl]propanoic acid Traditional Name: 3-[4-[1-[4-(2-carboxyethyl)phenyl]pyrrol-2-yl]phenyl]propionic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C2=CC=C(C=C2)CCC(=O)O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1=CN(C(=C1)C2=CC=C(C=C2)CCC(=O)O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C22H21NO4/c24-21(25)13-7-16-3-9-18(10-4-16)20-2-1-15-23(20)19-11-5-17(6-12-19)8-14-22(26)27/h1-6,9-12,15H,7-8,13-14H2,(H,24,25)(H,26,27)