terephthalate; triphenylene

Systemtic Name: terephthalate; triphenylene Openeye Name: terephthalate; triphenylene CAS Name: terephthalate; triphenylene IUPAC Name: terephthalate; triphenylene Traditional Name: terephthalate; triphenylene Formula: C26H16O4-2 MolecularWeight: 392.40284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24.C1=CC(=CC=C1C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24.C1=CC(=CC=C1C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H12.C8H6O4/c1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;9-7(10)5-1-2-6(4-3-5)8(11)12/h1-12H;1-4H,(H,9,10)(H,11,12)/p-2