3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate

Systemtic Name: 3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate Openeye Name: 3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate CAS Name: 3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate IUPAC Name: 3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate Traditional Name: 3-[1-(1,1-dibutoxyethoxy)ethyl]phthalate Formula: C20H28O7-2 MolecularWeight: 380.43212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)(OCCCC)OC(C)C1=CC=CC(=C1C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCOC(C)(OCCCC)OC(C)C1=CC=CC(=C1C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H30O7/c1-5-7-12-25-20(4,26-13-8-6-2)27-14(3)15-10-9-11-16(18(21)22)17(15)19(23)24/h9-11,14H,5-8,12-13H2,1-4H3,(H,21,22)(H,23,24)/p-2