3,4-dimethyl-7-(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-2-one

Systemtic Name: 3,4-dimethyl-7-(2H-1,2,3,4-tetrazol-5-ylmethoxy)chromen-2-one Openeye Name: 3,4-dimethyl-7-(2H-tetrazol-5-ylmethoxy)chromen-2-one CAS Name: 3,4-dimethyl-7-(2H-tetrazol-5-ylmethoxy)-1-benzopyran-2-one IUPAC Name: 3,4-dimethyl-7-(2H-tetrazol-5-ylmethoxy)chromen-2-one Traditional Name: 3,4-dimethyl-7-(2H-tetrazol-5-ylmethoxy)coumarin Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O3/c1-7-8(2)13(18)20-11-5-9(3-4-10(7)11)19-6-12-14-16-17-15-12/h3-5H,6H2,1-2H3,(H,14,15,16,17)