4-azanyl-3-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]benzoic acid

Systemtic Name: 4-azanyl-3-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]benzoic acid Openeye Name: 4-amino-3-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzoic acid CAS Name: 4-amino-3-[2-(2-oxo-1-imidazolidinyl)ethoxy]benzoic acid IUPAC Name: 4-amino-3-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzoic acid Traditional Name: 4-amino-3-[2-(2-ketoimidazolidin-1-yl)ethoxy]benzoic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1)CCOC2=C(C=CC(=C2)C(=O)O)N

Isomeric SMILES

C1CN(C(=O)N1)CCOC2=C(C=CC(=C2)C(=O)O)N

InChI

InChI=1S/C12H15N3O4/c13-9-2-1-8(11(16)17)7-10(9)19-6-5-15-4-3-14-12(15)18/h1-2,7H,3-6,13H2,(H,14,18)(H,16,17)