(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-thiophen-2-ylethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-thiophen-2-ylethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CC=CS3

InChI

InChI=1S/C14H11N3O3S/c18-13(8-10-4-3-7-21-10)20-9-17-14(19)11-5-1-2-6-12(11)15-16-17/h1-7H,8-9H2