2-ethoxycarbonylbenzoate; phthalate

Systemtic Name: 2-ethoxycarbonylbenzoate; phthalate Openeye Name: 2-ethoxycarbonylbenzoate; phthalate CAS Name: 2-ethoxycarbonylbenzoate; phthalate IUPAC Name: 2-ethoxycarbonylbenzoate; phthalate Traditional Name: 2-carbethoxybenzoate; phthalate Formula: C18H13O8-3 MolecularWeight: 357.29102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O4.C8H6O4/c1-2-14-10(13)8-6-4-3-5-7(8)9(11)12;9-7(10)5-3-1-2-4-6(5)8(11)12/h3-6H,2H2,1H3,(H,11,12);1-4H,(H,9,10)(H,11,12)/p-3