5-methyl-3,4-bis(2-methylpropyl)phthalate

Systemtic Name: 5-methyl-3,4-bis(2-methylpropyl)phthalate Openeye Name: 3,4-diisobutyl-5-methyl-phthalate CAS Name: 5-methyl-3,4-bis(2-methylpropyl)phthalate IUPAC Name: 5-methyl-3,4-bis(2-methylpropyl)phthalate Traditional Name: 3,4-diisobutyl-5-methyl-phthalate Formula: C17H22O4-2 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC(C)C)CC(C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC(C)C)CC(C)C

InChI

InChI=1S/C17H24O4/c1-9(2)6-12-11(5)8-14(16(18)19)15(17(20)21)13(12)7-10(3)4/h8-10H,6-7H2,1-5H3,(H,18,19)(H,20,21)/p-2