8-(2-azanyl-4-chloranyl-phenoxy)octanoic acid

Systemtic Name: 8-(2-azanyl-4-chloranyl-phenoxy)octanoic acid Openeye Name: 8-(2-amino-4-chloro-phenoxy)octanoic acid CAS Name: 8-(2-amino-4-chlorophenoxy)octanoic acid IUPAC Name: 8-(2-amino-4-chlorophenoxy)octanoic acid Traditional Name: 8-(2-amino-4-chloro-phenoxy)caprylic acid Formula: C14H20ClNO3 MolecularWeight: 285.7665

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)N)OCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)N)OCCCCCCCC(=O)O

InChI

InChI=1S/C14H20ClNO3/c15-11-7-8-13(12(16)10-11)19-9-5-3-1-2-4-6-14(17)18/h7-8,10H,1-6,9,16H2,(H,17,18)