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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C16H13N3O4S/c20-13(14-6-3-9-24-14)7-8-15(21)23-10-19-16(22)11-4-1-2-5-12(11)17-18-19/h1-6,9H,7-8,10H2