3-[[5-azanyl-4-(methyldiazenyl)-2-sulfo-phenyl]amino]propanoic acid

Systemtic Name: 3-[[5-azanyl-4-(methyldiazenyl)-2-sulfo-phenyl]amino]propanoic acid Openeye Name: 3-(5-amino-4-methylazo-2-sulfo-anilino)propanoic acid CAS Name: 3-(5-amino-4-methylazo-2-sulfoanilino)propanoic acid IUPAC Name: 3-[5-amino-4-(methyldiazenyl)-2-sulfoanilino]propanoic acid Traditional Name: 3-(5-amino-4-methylazo-2-sulfo-anilino)propionic acid Formula: C10H14N4O5S MolecularWeight: 302.30696

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Descriptors Computed from Structure

Canonical SMILES:

CN=NC1=CC(=C(C=C1N)NCCC(=O)O)S(=O)(=O)O

Isomeric SMILES

CN=NC1=CC(=C(C=C1N)NCCC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C10H14N4O5S/c1-12-14-7-5-9(20(17,18)19)8(4-6(7)11)13-3-2-10(15)16/h4-5,13H,2-3,11H2,1H3,(H,15,16)(H,17,18,19)