2-[4-(4-acetamido-3-phenyl-phenoxy)-3,5-bis(chloranyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-acetamido-3-phenyl-phenoxy)-3,5-bis(chloranyl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-acetamido-3-phenyl-phenoxy)-3,5-dichloro-phenyl]acetic acid CAS Name: 2-[4-(4-acetamido-3-phenylphenoxy)-3,5-dichlorophenyl]acetic acid IUPAC Name: 2-[4-(4-acetamido-3-phenylphenoxy)-3,5-dichlorophenyl]acetic acid Traditional Name: 2-[4-(4-acetamido-3-phenyl-phenoxy)-3,5-dichloro-phenyl]acetic acid Formula: C22H17Cl2NO4 MolecularWeight: 430.28068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)CC(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)OC2=C(C=C(C=C2Cl)CC(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H17Cl2NO4/c1-13(26)25-20-8-7-16(12-17(20)15-5-3-2-4-6-15)29-22-18(23)9-14(10-19(22)24)11-21(27)28/h2-10,12H,11H2,1H3,(H,25,26)(H,27,28)