(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-[(3-chlorophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[(3-chlorophenyl)sulfonylamino]-3-methyl-butyric acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H19ClN4O5S MolecularWeight: 450.89596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2N=N1)NS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)OCN1C(=O)C2=CC=CC=C2N=N1)NS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H19ClN4O5S/c1-12(2)17(22-30(27,28)14-7-5-6-13(20)10-14)19(26)29-11-24-18(25)15-8-3-4-9-16(15)21-23-24/h3-10,12,17,22H,11H2,1-2H3