(2S)-2-azanyl-3-[oxidanyl-(3-sulfophenyl)carbamoyl]oxy-propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[oxidanyl-(3-sulfophenyl)carbamoyl]oxy-propanoic acid Openeye Name: (2S)-2-amino-3-[hydroxy-(3-sulfophenyl)carbamoyl]oxy-propanoic acid CAS Name: (2S)-2-amino-3-[(N-hydroxy-3-sulfoanilino)-oxomethoxy]propanoic acid IUPAC Name: (2S)-2-amino-3-[hydroxy-(3-sulfophenyl)carbamoyl]oxypropanoic acid Traditional Name: (2S)-2-amino-3-[hydroxy-(3-sulfophenyl)carbamoyl]oxy-propionic acid Formula: C10H12N2O8S MolecularWeight: 320.27588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)N(C(=O)OCC(C(=O)O)N)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)N(C(=O)OC[C@@H](C(=O)O)N)O

InChI

InChI=1S/C10H12N2O8S/c11-8(9(13)14)5-20-10(15)12(16)6-2-1-3-7(4-6)21(17,18)19/h1-4,8,16H,5,11H2,(H,13,14)(H,17,18,19)/t8-/m0/s1