4-(3-azanyl-4-nitro-5-oxidanyl-thiophen-2-yl)butanoic acid

Systemtic Name: 4-(3-azanyl-4-nitro-5-oxidanyl-thiophen-2-yl)butanoic acid Openeye Name: 4-(3-amino-5-hydroxy-4-nitro-2-thienyl)butanoic acid CAS Name: 4-(3-amino-5-hydroxy-4-nitro-2-thiophenyl)butanoic acid IUPAC Name: 4-(3-amino-5-hydroxy-4-nitrothiophen-2-yl)butanoic acid Traditional Name: 4-(3-amino-5-hydroxy-4-nitro-2-thienyl)butyric acid Formula: C8H10N2O5S MolecularWeight: 246.2404

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Descriptors Computed from Structure

Canonical SMILES:

C(CC1=C(C(=C(S1)O)[N+](=O)[O-])N)CC(=O)O

Isomeric SMILES

C(CC1=C(C(=C(S1)O)[N+](=O)[O-])N)CC(=O)O

InChI

InChI=1S/C8H10N2O5S/c9-6-4(2-1-3-5(11)12)16-8(13)7(6)10(14)15/h13H,1-3,9H2,(H,11,12)