2-[1-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propoxy]propyl]-5-ethoxy-5-oxidanylidene-2-phenoxy-pentanoic acid

Systemtic Name: 2-[1-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propoxy]propyl]-5-ethoxy-5-oxidanylidene-2-phenoxy-pentanoic acid Openeye Name: 2-[1-[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propoxy]propyl]-5-ethoxy-5-oxo-2-phenoxy-pentanoic acid CAS Name: 2-[1-[3-(4-acetyl-3-methoxy-2-propylphenoxy)propoxy]propyl]-5-ethoxy-5-oxo-2-phenoxypentanoic acid IUPAC Name: 2-[1-[3-(4-acetyl-3-methoxy-2-propylphenoxy)propoxy]propyl]-5-ethoxy-5-oxo-2-phenoxypentanoic acid Traditional Name: 2-[1-[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propoxy]propyl]-5-ethoxy-5-keto-2-phenoxy-valeric acid Formula: C31H42O9 MolecularWeight: 558.65978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC)C(=O)C)OCCCOC(CC)C(CCC(=O)OCC)(C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CCCC1=C(C=CC(=C1OC)C(=O)C)OCCCOC(CC)C(CCC(=O)OCC)(C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C31H42O9/c1-6-13-25-26(17-16-24(22(4)32)29(25)36-5)38-20-12-21-39-27(7-2)31(30(34)35,19-18-28(33)37-8-3)40-23-14-10-9-11-15-23/h9-11,14-17,27H,6-8,12-13,18-21H2,1-5H3,(H,34,35)