2-[6-[5-[2,3-bis(chloranyl)-5,6-bis(oxidanyl)phenyl]pentoxy]naphthalen-2-yl]ethanoic acid; methane

Systemtic Name: 2-[6-[5-[2,3-bis(chloranyl)-5,6-bis(oxidanyl)phenyl]pentoxy]naphthalen-2-yl]ethanoic acid; methane Openeye Name: 2-[6-[5-(2,3-dichloro-5,6-dihydroxy-phenyl)pentoxy]-2-naphthyl]acetic acid; methane CAS Name: 2-[6-[5-(2,3-dichloro-5,6-dihydroxyphenyl)pentoxy]-2-naphthalenyl]acetic acid; methane IUPAC Name: 2-[6-[5-(2,3-dichloro-5,6-dihydroxyphenyl)pentoxy]naphthalen-2-yl]acetic acid; methane Traditional Name: 2-[6-[5-(2,3-dichloro-5,6-dihydroxy-phenyl)pentoxy]-2-naphthyl]acetic acid; methane Formula: C24H26Cl2O5 MolecularWeight: 465.36624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C.C1=CC2=C(C=CC(=C2)OCCCCCC3=C(C(=CC(=C3Cl)Cl)O)O)C=C1CC(=O)O

Isomeric SMILES

C.C1=CC2=C(C=CC(=C2)OCCCCCC3=C(C(=CC(=C3Cl)Cl)O)O)C=C1CC(=O)O

InChI

InChI=1S/C23H22Cl2O5.CH4/c24-19-13-20(26)23(29)18(22(19)25)4-2-1-3-9-30-17-8-7-15-10-14(11-21(27)28)5-6-16(15)12-17;/h5-8,10,12-13,26,29H,1-4,9,11H2,(H,27,28);1H4