6-[2-oxidanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-6-yl]oxyhexanoic acid

Systemtic Name: 6-[2-oxidanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-6-yl]oxyhexanoic acid Openeye Name: 6-[2-oxo-3-(2H-tetrazol-5-yl)chromen-6-yl]oxyhexanoic acid CAS Name: 6-[[2-oxo-3-(2H-tetrazol-5-yl)-1-benzopyran-6-yl]oxy]hexanoic acid IUPAC Name: 6-[2-oxo-3-(2H-tetrazol-5-yl)chromen-6-yl]oxyhexanoic acid Traditional Name: 6-[2-keto-3-(2H-tetrazol-5-yl)chromen-6-yl]oxyhexanoic acid Formula: C16H16N4O5 MolecularWeight: 344.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCCCCCC(=O)O)C=C(C(=O)O2)C3=NNN=N3

Isomeric SMILES

C1=CC2=C(C=C1OCCCCCC(=O)O)C=C(C(=O)O2)C3=NNN=N3

InChI

InChI=1S/C16H16N4O5/c21-14(22)4-2-1-3-7-24-11-5-6-13-10(8-11)9-12(16(23)25-13)15-17-19-20-18-15/h5-6,8-9H,1-4,7H2,(H,21,22)(H,17,18,19,20)