4-[2-[6,7-bis(oxidanyl)naphthalen-2-yl]ethoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[2-[6,7-bis(oxidanyl)naphthalen-2-yl]ethoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[2-(6,7-dihydroxy-2-naphthyl)ethoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[2-(6,7-dihydroxy-2-naphthalenyl)ethoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[2-(6,7-dihydroxynaphthalen-2-yl)ethoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[2-(6,7-dihydroxy-2-naphthyl)ethoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCC2=CC3=CC(=C(C=C3C=C2)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCC2=CC3=CC(=C(C=C3C=C2)O)O

InChI

InChI=1S/C22H22O6/c1-2-3-16-20(7-6-17(21(16)25)22(26)27)28-9-8-13-4-5-14-11-18(23)19(24)12-15(14)10-13/h4-7,10-12,23-25H,2-3,8-9H2,1H3,(H,26,27)