2-[3-(3-chlorophenyl)carbonylpyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(3-chlorophenyl)carbonylpyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-(3-chlorobenzoyl)pyrrol-1-yl]acetic acid CAS Name: 2-[3-[(3-chlorophenyl)-oxomethyl]-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-(3-chlorobenzoyl)pyrrol-1-yl]acetic acid Traditional Name: 2-[3-(3-chlorobenzoyl)pyrrol-1-yl]acetic acid Formula: C13H10ClNO3 MolecularWeight: 263.6764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClNO3/c14-11-3-1-2-9(6-11)13(18)10-4-5-15(7-10)8-12(16)17/h1-7H,8H2,(H,16,17)