(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11N3O3S/c19-14(6-5-11-7-8-22-9-11)21-10-18-15(20)12-3-1-2-4-13(12)16-17-18/h1-9H,10H2/b6-5+