3-[4-methyl-2-oxidanylidene-7-(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-3-yl]propanoic acid

Systemtic Name: 3-[4-methyl-2-oxidanylidene-7-(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-3-yl]propanoic acid Openeye Name: 3-[4-methyl-2-oxo-7-(2H-tetrazol-5-ylmethoxy)chromen-3-yl]propanoic acid CAS Name: 3-[4-methyl-2-oxo-7-(2H-tetrazol-5-ylmethoxy)-1-benzopyran-3-yl]propanoic acid IUPAC Name: 3-[4-methyl-2-oxo-7-(2H-tetrazol-5-ylmethoxy)chromen-3-yl]propanoic acid Traditional Name: 3-[2-keto-4-methyl-7-(2H-tetrazol-5-ylmethoxy)chromen-3-yl]propionic acid Formula: C15H14N4O5 MolecularWeight: 330.29546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=NNN=N3)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=NNN=N3)CCC(=O)O

InChI

InChI=1S/C15H14N4O5/c1-8-10-3-2-9(23-7-13-16-18-19-17-13)6-12(10)24-15(22)11(8)4-5-14(20)21/h2-3,6H,4-5,7H2,1H3,(H,20,21)(H,16,17,18,19)