3,4-bis(8-methylnonyl)phthalate

Systemtic Name: 3,4-bis(8-methylnonyl)phthalate Openeye Name: 3,4-bis(8-methylnonyl)phthalate CAS Name: 3,4-bis(8-methylnonyl)phthalate IUPAC Name: 3,4-bis(8-methylnonyl)phthalate Traditional Name: 3,4-bis(8-methylnonyl)phthalate Formula: C28H44O4-2 MolecularWeight: 444.64656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCCCC(C)C

InChI

InChI=1S/C28H46O4/c1-21(2)15-11-7-5-9-13-17-23-19-20-25(27(29)30)26(28(31)32)24(23)18-14-10-6-8-12-16-22(3)4/h19-22H,5-18H2,1-4H3,(H,29,30)(H,31,32)/p-2