(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (2R)-2-(4-cyanophenoxy)propanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (2R)-2-(4-cyanophenoxy)propanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (2R)-2-(4-cyanophenoxy)propanoate CAS Name: (2R)-2-(4-cyanophenoxy)propanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (2R)-2-(4-cyanophenoxy)propanoate Traditional Name: (2R)-2-(4-cyanophenoxy)propionic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCN1C(=O)C2=CC=CC=C2N=N1)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@H](C(=O)OCN1C(=O)C2=CC=CC=C2N=N1)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H14N4O4/c1-12(26-14-8-6-13(10-19)7-9-14)18(24)25-11-22-17(23)15-4-2-3-5-16(15)20-21-22/h2-9,12H,11H2,1H3/t12-/m1/s1