1-[2,3-bis(chloranyl)-4-pentanoyl-phenoxy]cyclobutane-1-carboxylic acid

Systemtic Name: 1-[2,3-bis(chloranyl)-4-pentanoyl-phenoxy]cyclobutane-1-carboxylic acid Openeye Name: 1-(2,3-dichloro-4-pentanoyl-phenoxy)cyclobutanecarboxylic acid CAS Name: 1-[2,3-dichloro-4-(1-oxopentyl)phenoxy]-1-cyclobutanecarboxylic acid IUPAC Name: 1-(2,3-dichloro-4-pentanoylphenoxy)cyclobutane-1-carboxylic acid Traditional Name: 1-(2,3-dichloro-4-valeryl-phenoxy)cyclobutanecarboxylic acid Formula: C16H18Cl2O4 MolecularWeight: 345.21772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(C(=C(C=C1)OC2(CCC2)C(=O)O)Cl)Cl

Isomeric SMILES

CCCCC(=O)C1=C(C(=C(C=C1)OC2(CCC2)C(=O)O)Cl)Cl

InChI

InChI=1S/C16H18Cl2O4/c1-2-3-5-11(19)10-6-7-12(14(18)13(10)17)22-16(15(20)21)8-4-9-16/h6-7H,2-5,8-9H2,1H3,(H,20,21)