2-(3-chloranyl-4-octoxy-phenyl)ethanoic acid

Systemtic Name: 2-(3-chloranyl-4-octoxy-phenyl)ethanoic acid Openeye Name: 2-(3-chloro-4-octoxy-phenyl)acetic acid CAS Name: 2-(3-chloro-4-octoxyphenyl)acetic acid IUPAC Name: 2-(3-chloro-4-octoxyphenyl)acetic acid Traditional Name: 2-(3-chloro-4-octoxy-phenyl)acetic acid Formula: C16H23ClO3 MolecularWeight: 298.80502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)CC(=O)O)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)CC(=O)O)Cl

InChI

InChI=1S/C16H23ClO3/c1-2-3-4-5-6-7-10-20-15-9-8-13(11-14(15)17)12-16(18)19/h8-9,11H,2-7,10,12H2,1H3,(H,18,19)