4-[5-(6,7-dimethoxynaphthalen-2-yl)-5-oxidanylidene-pentoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[5-(6,7-dimethoxynaphthalen-2-yl)-5-oxidanylidene-pentoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[5-(6,7-dimethoxy-2-naphthyl)-5-oxo-pentoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[5-(6,7-dimethoxy-2-naphthalenyl)-5-oxopentoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[5-(6,7-dimethoxynaphthalen-2-yl)-5-oxopentoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[5-(6,7-dimethoxy-2-naphthyl)-5-keto-pentoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C27H30O7 MolecularWeight: 466.5229

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCC(=O)C2=CC3=CC(=C(C=C3C=C2)OC)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCC(=O)C2=CC3=CC(=C(C=C3C=C2)OC)OC

InChI

InChI=1S/C27H30O7/c1-4-7-20-23(12-11-21(26(20)29)27(30)31)34-13-6-5-8-22(28)18-10-9-17-15-24(32-2)25(33-3)16-19(17)14-18/h9-12,14-16,29H,4-8,13H2,1-3H3,(H,30,31)