6-[5-[2,3,4-tris(chloranyl)-5,6-bis(oxidanyl)phenyl]pentoxy]naphthalene-2-carboxylic acid

Systemtic Name: 6-[5-[2,3,4-tris(chloranyl)-5,6-bis(oxidanyl)phenyl]pentoxy]naphthalene-2-carboxylic acid Openeye Name: 6-[5-(2,3,4-trichloro-5,6-dihydroxy-phenyl)pentoxy]naphthalene-2-carboxylic acid CAS Name: 6-[5-(2,3,4-trichloro-5,6-dihydroxyphenyl)pentoxy]-2-naphthalenecarboxylic acid IUPAC Name: 6-[5-(2,3,4-trichloro-5,6-dihydroxyphenyl)pentoxy]naphthalene-2-carboxylic acid Traditional Name: 6-[5-(2,3,4-trichloro-5,6-dihydroxy-phenyl)pentoxy]-2-naphthoic acid Formula: C22H19Cl3O5 MolecularWeight: 469.74226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)OCCCCCC3=C(C(=C(C(=C3Cl)Cl)Cl)O)O)C=C1C(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)OCCCCCC3=C(C(=C(C(=C3Cl)Cl)Cl)O)O)C=C1C(=O)O

InChI

InChI=1S/C22H19Cl3O5/c23-17-16(20(26)21(27)19(25)18(17)24)4-2-1-3-9-30-15-8-7-12-10-14(22(28)29)6-5-13(12)11-15/h5-8,10-11,26-27H,1-4,9H2,(H,28,29)