8-[(2E)-2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(2E)-2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl]-8-oxidanylidene-octanoic acid Openeye Name: 8-[(2E)-2-[(5-nitro-2-thienyl)methylene]hydrazino]-8-oxo-octanoic acid CAS Name: 8-[(2E)-2-[(5-nitro-2-thiophenyl)methylidene]hydrazinyl]-8-oxooctanoic acid IUPAC Name: 8-[(2E)-2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl]-8-oxooctanoic acid Traditional Name: 8-keto-8-[(N'E)-N'-[(5-nitro-2-thienyl)methylene]hydrazino]caprylic acid Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)[N+](=O)[O-])C=NNC(=O)CCCCCCC(=O)O

Isomeric SMILES

C1=C(SC(=C1)[N+](=O)[O-])/C=N/NC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C13H17N3O5S/c17-11(5-3-1-2-4-6-13(18)19)15-14-9-10-7-8-12(22-10)16(20)21/h7-9H,1-6H2,(H,15,17)(H,18,19)/b14-9+