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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CSC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CC3=CSC=C3

InChI

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