2,3-di(pentan-2-yl)terephthalate

Systemtic Name: 2,3-di(pentan-2-yl)terephthalate Openeye Name: 2,3-bis(1-methylbutyl)terephthalate CAS Name: 2,3-di(pentan-2-yl)terephthalate IUPAC Name: 2,3-di(pentan-2-yl)terephthalate Traditional Name: 2,3-bis(1-methylbutyl)terephthalate Formula: C18H24O4-2 MolecularWeight: 304.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=C(C=CC(=C1C(C)CCC)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC(C)C1=C(C=CC(=C1C(C)CCC)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H26O4/c1-5-7-11(3)15-13(17(19)20)9-10-14(18(21)22)16(15)12(4)8-6-2/h9-12H,5-8H2,1-4H3,(H,19,20)(H,21,22)/p-2