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sodium 4-methylphthalate

sodium 4-methylphthalate

Systemtic Name:sodium 4-methylphthalate
Openeye Name:sodium 4-methylphthalate
CAS Name:sodium 4-methylphthalate
IUPAC Name:sodium 4-methylphthalate
Traditional Name:sodium 4-methylphthalate
Formula: C9H6NaO4-
MolecularWeight: 201.13131
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)[O-])C(=O)[O-].[Na+]


Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)[O-])C(=O)[O-].[Na+]


InChI

InChI=1S/C9H8O4.Na/c1-5-2-3-6(8(10)11)7(4-5)9(12)13;/h2-4H,1H3,(H,10,11)(H,12,13);/q;+1/p-2


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