(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[(2-fluorophenyl)sulfonylamino]-3-phenylpropanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(2-fluorophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propionic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C23H19FN4O5S MolecularWeight: 482.484163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NS(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)NS(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H19FN4O5S/c24-18-11-5-7-13-21(18)34(31,32)26-20(14-16-8-2-1-3-9-16)23(30)33-15-28-22(29)17-10-4-6-12-19(17)25-27-28/h1-13,20,26H,14-15H2