6-[4-azanyl-5-(4-oxidanidyl-4-oxidanylidene-butyl)thiophen-2-yl]hexanoate

Systemtic Name: 6-[4-azanyl-5-(4-oxidanidyl-4-oxidanylidene-butyl)thiophen-2-yl]hexanoate Openeye Name: 6-[4-amino-5-(4-oxido-4-oxo-butyl)-2-thienyl]hexanoate CAS Name: 6-[4-amino-5-(4-oxido-4-oxobutyl)-2-thiophenyl]hexanoate IUPAC Name: 6-[4-amino-5-(4-oxido-4-oxobutyl)thiophen-2-yl]hexanoate Traditional Name: 6-[4-amino-5-(4-keto-4-oxido-butyl)-2-thienyl]hexanoate Formula: C14H19NO4S-2 MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1N)CCCC(=O)[O-])CCCCCC(=O)[O-]

Isomeric SMILES

C1=C(SC(=C1N)CCCC(=O)[O-])CCCCCC(=O)[O-]

InChI

InChI=1S/C14H21NO4S/c15-11-9-10(5-2-1-3-7-13(16)17)20-12(11)6-4-8-14(18)19/h9H,1-8,15H2,(H,16,17)(H,18,19)/p-2