5-(4-chloranyl-3-methyl-phenoxy)pentanoic acid

Systemtic Name: 5-(4-chloranyl-3-methyl-phenoxy)pentanoic acid Openeye Name: 5-(4-chloro-3-methyl-phenoxy)pentanoic acid CAS Name: 5-(4-chloro-3-methylphenoxy)pentanoic acid IUPAC Name: 5-(4-chloro-3-methylphenoxy)pentanoic acid Traditional Name: 5-(4-chloro-3-methyl-phenoxy)valeric acid Formula: C12H15ClO3 MolecularWeight: 242.6987

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCCC(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCCC(=O)O)Cl

InChI

InChI=1S/C12H15ClO3/c1-9-8-10(5-6-11(9)13)16-7-3-2-4-12(14)15/h5-6,8H,2-4,7H2,1H3,(H,14,15)