4-[2-[[4-(chloromethyl)phenyl]carbonylamino]phenoxy]butanoic acid

Systemtic Name: 4-[2-[[4-(chloromethyl)phenyl]carbonylamino]phenoxy]butanoic acid Openeye Name: 4-[2-[[4-(chloromethyl)benzoyl]amino]phenoxy]butanoic acid CAS Name: 4-[2-[[[4-(chloromethyl)phenyl]-oxomethyl]amino]phenoxy]butanoic acid IUPAC Name: 4-[2-[[4-(chloromethyl)benzoyl]amino]phenoxy]butanoic acid Traditional Name: 4-[2-[[4-(chloromethyl)benzoyl]amino]phenoxy]butyric acid Formula: C18H18ClNO4 MolecularWeight: 347.79282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)CCl)OCCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)CCl)OCCCC(=O)O

InChI

InChI=1S/C18H18ClNO4/c19-12-13-7-9-14(10-8-13)18(23)20-15-4-1-2-5-16(15)24-11-3-6-17(21)22/h1-2,4-5,7-10H,3,6,11-12H2,(H,20,23)(H,21,22)