8-[(3-chlorophenyl)-(2-chlorophenyl)carbonyl-amino]octanoic acid

Systemtic Name: 8-[(3-chlorophenyl)-(2-chlorophenyl)carbonyl-amino]octanoic acid Openeye Name: 8-(3-chloro-N-(2-chlorobenzoyl)anilino)octanoic acid CAS Name: 8-(3-chloro-N-[(2-chlorophenyl)-oxomethyl]anilino)octanoic acid IUPAC Name: 8-(3-chloro-N-(2-chlorobenzoyl)anilino)octanoic acid Traditional Name: 8-(3-chloro-N-(2-chlorobenzoyl)anilino)caprylic acid Formula: C21H23Cl2NO3 MolecularWeight: 408.31822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N(CCCCCCCC(=O)O)C2=CC(=CC=C2)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N(CCCCCCCC(=O)O)C2=CC(=CC=C2)Cl)Cl

InChI

InChI=1S/C21H23Cl2NO3/c22-16-9-8-10-17(15-16)24(14-7-3-1-2-4-13-20(25)26)21(27)18-11-5-6-12-19(18)23/h5-6,8-12,15H,1-4,7,13-14H2,(H,25,26)