sodium 2-[(4-aminophenyl)carbonylamino]ethanoate hydrate

Systemtic Name: sodium 2-[(4-aminophenyl)carbonylamino]ethanoate hydrate Openeye Name: sodium 2-[(4-aminobenzoyl)amino]acetate hydrate CAS Name: sodium 2-[[(4-aminophenyl)-oxomethyl]amino]acetate hydrate IUPAC Name: sodium 2-[(4-aminobenzoyl)amino]acetate hydrate Traditional Name: sodium 2-[(4-aminobenzoyl)amino]acetate hydrate Formula: C9H11N2NaO4 MolecularWeight: 234.18441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)[O-])N.O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)[O-])N.O.[Na+]

InChI

InChI=1S/C9H10N2O3.Na.H2O/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13;;/h1-4H,5,10H2,(H,11,14)(H,12,13);;1H2/q;+1;/p-1