2-[5-(4-chlorophenyl)carbonyl-1-propyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(4-chlorophenyl)carbonyl-1-propyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-(4-chlorobenzoyl)-1-propyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-[(4-chlorophenyl)-oxomethyl]-1-propyl-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(4-chlorobenzoyl)-1-propylpyrrol-2-yl]acetic acid Traditional Name: 2-[5-(4-chlorobenzoyl)-1-propyl-pyrrol-2-yl]acetic acid Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC=C1C(=O)C2=CC=C(C=C2)Cl)CC(=O)O

Isomeric SMILES

CCCN1C(=CC=C1C(=O)C2=CC=C(C=C2)Cl)CC(=O)O

InChI

InChI=1S/C16H16ClNO3/c1-2-9-18-13(10-15(19)20)7-8-14(18)16(21)11-3-5-12(17)6-4-11/h3-8H,2,9-10H2,1H3,(H,19,20)