4-[(2-azanyl-4-sulfo-phenyl)amino]butanoic acid

Systemtic Name: 4-[(2-azanyl-4-sulfo-phenyl)amino]butanoic acid Openeye Name: 4-(2-amino-4-sulfo-anilino)butanoic acid CAS Name: 4-(2-amino-4-sulfoanilino)butanoic acid IUPAC Name: 4-(2-amino-4-sulfoanilino)butanoic acid Traditional Name: 4-(2-amino-4-sulfo-anilino)butyric acid Formula: C10H14N2O5S MolecularWeight: 274.29356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)N)NCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)N)NCCCC(=O)O

InChI

InChI=1S/C10H14N2O5S/c11-8-6-7(18(15,16)17)3-4-9(8)12-5-1-2-10(13)14/h3-4,6,12H,1-2,5,11H2,(H,13,14)(H,15,16,17)