2-[5-(2,4-dichlorophenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]butanoic acid

Systemtic Name: 2-[5-(2,4-dichlorophenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]butanoic acid Openeye Name: 2-[1-benzyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]butanoic acid CAS Name: 2-[5-[(2,4-dichlorophenyl)-oxomethyl]-1-(phenylmethyl)-2-pyrrolyl]butanoic acid IUPAC Name: 2-[1-benzyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]butanoic acid Traditional Name: 2-[1-benzyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]butyric acid Formula: C22H19Cl2NO3 MolecularWeight: 416.29716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(N1CC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(N1CC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C22H19Cl2NO3/c1-2-16(22(27)28)19-10-11-20(25(19)13-14-6-4-3-5-7-14)21(26)17-9-8-15(23)12-18(17)24/h3-12,16H,2,13H2,1H3,(H,27,28)