3-[[4-[(3-chloranyl-2-methyl-phenyl)carbamoyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[(3-chloranyl-2-methyl-phenyl)carbamoyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[(3-chloro-2-methyl-phenyl)carbamoyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[(3-chloro-2-methylanilino)-oxomethyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[(3-chloro-2-methylphenyl)carbamoyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[(3-chloro-2-methyl-phenyl)carbamoyl]phenoxy]methyl]benzoic acid Formula: C22H18ClNO4 MolecularWeight: 395.83562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C22H18ClNO4/c1-14-19(23)6-3-7-20(14)24-21(25)16-8-10-18(11-9-16)28-13-15-4-2-5-17(12-15)22(26)27/h2-12H,13H2,1H3,(H,24,25)(H,26,27)