4-butyl-3-(6-methylheptyl)phthalate

Systemtic Name: 4-butyl-3-(6-methylheptyl)phthalate Openeye Name: 4-butyl-3-(6-methylheptyl)phthalate CAS Name: 4-butyl-3-(6-methylheptyl)phthalate IUPAC Name: 4-butyl-3-(6-methylheptyl)phthalate Traditional Name: 4-butyl-3-(6-methylheptyl)phthalate Formula: C20H28O4-2 MolecularWeight: 332.43392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCC(C)C

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCC(C)C

InChI

InChI=1S/C20H30O4/c1-4-5-10-15-12-13-17(19(21)22)18(20(23)24)16(15)11-8-6-7-9-14(2)3/h12-14H,4-11H2,1-3H3,(H,21,22)(H,23,24)/p-2