5-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]pentanoic acid

Systemtic Name: 5-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]pentanoic acid Openeye Name: 5-(4-chloro-2,5-dimethoxy-anilino)pentanoic acid CAS Name: 5-(4-chloro-2,5-dimethoxyanilino)pentanoic acid IUPAC Name: 5-(4-chloro-2,5-dimethoxyanilino)pentanoic acid Traditional Name: 5-(4-chloro-2,5-dimethoxy-anilino)valeric acid Formula: C13H18ClNO4 MolecularWeight: 287.73932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NCCCCC(=O)O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NCCCCC(=O)O)OC)Cl

InChI

InChI=1S/C13H18ClNO4/c1-18-11-8-10(12(19-2)7-9(11)14)15-6-4-3-5-13(16)17/h7-8,15H,3-6H2,1-2H3,(H,16,17)