diazanium 3-[3-(3-carboxylatophenyl)carbonyloxyphenoxy]carbonylbenzoate

Systemtic Name: diazanium 3-[3-(3-carboxylatophenyl)carbonyloxyphenoxy]carbonylbenzoate Openeye Name: diammonium 3-[3-(3-carboxylatobenzoyl)oxyphenoxy]carbonylbenzoate CAS Name: diammonium 3-[[3-[(3-carboxylatophenyl)-oxomethoxy]phenoxy]-oxomethyl]benzoate IUPAC Name: diazanium 3-[3-(3-carboxylatobenzoyl)oxyphenoxy]carbonylbenzoate Traditional Name: diammonium 3-[3-(3-carboxylatobenzoyl)oxyphenoxy]carbonylbenzoate Formula: C22H20N2O8 MolecularWeight: 440.4028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC(=C3)C(=O)[O-])C(=O)[O-].[NH4+].[NH4+]

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC(=C3)C(=O)[O-])C(=O)[O-].[NH4+].[NH4+]

InChI

InChI=1S/C22H14O8.2H3N/c23-19(24)13-4-1-6-15(10-13)21(27)29-17-8-3-9-18(12-17)30-22(28)16-7-2-5-14(11-16)20(25)26;;/h1-12H,(H,23,24)(H,25,26);2*1H3