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butanedioic acid; hexanedioic acid; terephthalate

butanedioic acid; hexanedioic acid; terephthalate

Systemtic Name:butanedioic acid; hexanedioic acid; terephthalate
Openeye Name:adipic acid; succinic acid; terephthalate
CAS Name:butanedioic acid; hexanedioic acid; terephthalate
IUPAC Name:butanedioic acid; hexanedioic acid; terephthalate
Traditional Name:adipic acid; succinic acid; terephthalate
Formula: C18H20O12-2
MolecularWeight: 428.3442
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C8H6O4.C6H10O4.C4H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12;7-5(8)3-1-2-4-6(9)10;5-3(6)1-2-4(7)8/h1-4H,(H,9,10)(H,11,12);1-4H2,(H,7,8)(H,9,10);1-2H2,(H,5,6)(H,7,8)/p-2


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