sodium 6-[5-(2-ethanoyl-3-prop-2-enoxy-phenoxy)pentoxy]naphthalene-2-carboxylate

Systemtic Name: sodium 6-[5-(2-ethanoyl-3-prop-2-enoxy-phenoxy)pentoxy]naphthalene-2-carboxylate Openeye Name: sodium 6-[5-(2-acetyl-3-allyloxy-phenoxy)pentoxy]naphthalene-2-carboxylate CAS Name: sodium 6-[5-(2-acetyl-3-prop-2-enoxyphenoxy)pentoxy]-2-naphthalenecarboxylate IUPAC Name: sodium 6-[5-(2-acetyl-3-prop-2-enoxyphenoxy)pentoxy]naphthalene-2-carboxylate Traditional Name: sodium 6-[5-(2-acetyl-3-allyloxy-phenoxy)pentoxy]-2-naphthoate Formula: C27H27NaO6 MolecularWeight: 470.48945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC=C1OCCCCCOC2=CC3=C(C=C2)C=C(C=C3)C(=O)[O-])OCC=C.[Na+]

Isomeric SMILES

CC(=O)C1=C(C=CC=C1OCCCCCOC2=CC3=C(C=C2)C=C(C=C3)C(=O)[O-])OCC=C.[Na+]

InChI

InChI=1S/C27H28O6.Na/c1-3-14-32-24-8-7-9-25(26(24)19(2)28)33-16-6-4-5-15-31-23-13-12-20-17-22(27(29)30)11-10-21(20)18-23;/h3,7-13,17-18H,1,4-6,14-16H2,2H3,(H,29,30);/q;+1/p-1