4-[3-[2-(4-chlorophenyl)ethanoylamino]phenoxy]phthalic acid

Systemtic Name: 4-[3-[2-(4-chlorophenyl)ethanoylamino]phenoxy]phthalic acid Openeye Name: 4-[3-[[2-(4-chlorophenyl)acetyl]amino]phenoxy]phthalic acid CAS Name: 4-[3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]phenoxy]phthalic acid IUPAC Name: 4-[3-[[2-(4-chlorophenyl)acetyl]amino]phenoxy]phthalic acid Traditional Name: 4-[3-[[2-(4-chlorophenyl)acetyl]amino]phenoxy]phthalic acid Formula: C22H16ClNO6 MolecularWeight: 425.81854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H16ClNO6/c23-14-6-4-13(5-7-14)10-20(25)24-15-2-1-3-16(11-15)30-17-8-9-18(21(26)27)19(12-17)22(28)29/h1-9,11-12H,10H2,(H,24,25)(H,26,27)(H,28,29)