sodium 6-ethanoyl-7-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylate

Systemtic Name: sodium 6-ethanoyl-7-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylate Openeye Name: sodium 6-acetyl-7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chromane-2-carboxylate CAS Name: sodium 6-acetyl-7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylate IUPAC Name: sodium 6-acetyl-7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylate Traditional Name: sodium 6-acetyl-7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chroman-2-carboxylate Formula: C28H33NaO8 MolecularWeight: 520.54659

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CCC(O3)C(=O)[O-])C=C2C(=O)C.[Na+]

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CCC(O3)C(=O)[O-])C=C2C(=O)C.[Na+]

InChI

InChI=1S/C28H34O8.Na/c1-4-8-21-23(12-10-20(17(2)29)27(21)31)34-13-6-5-7-14-35-26-16-25-19(15-22(26)18(3)30)9-11-24(36-25)28(32)33;/h10,12,15-16,24,31H,4-9,11,13-14H2,1-3H3,(H,32,33);/q;+1/p-1