2-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]heptanoic acid

Systemtic Name: 2-[2-chloranyl-4-(2-methylbutan-2-yl)phenoxy]heptanoic acid Openeye Name: 2-[2-chloro-4-(1,1-dimethylpropyl)phenoxy]heptanoic acid CAS Name: 2-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]heptanoic acid IUPAC Name: 2-[2-chloro-4-(2-methylbutan-2-yl)phenoxy]heptanoic acid Traditional Name: 2-(4-tert-amyl-2-chloro-phenoxy)enanthic acid Formula: C18H27ClO3 MolecularWeight: 326.85818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)Cl

Isomeric SMILES

CCCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)Cl

InChI

InChI=1S/C18H27ClO3/c1-5-7-8-9-16(17(20)21)22-15-11-10-13(12-14(15)19)18(3,4)6-2/h10-12,16H,5-9H2,1-4H3,(H,20,21)