methyl 4-chloranyl-2-[[3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[[3-methyl-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate Openeye Name: methyl 4-chloro-2-[[3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate CAS Name: 4-chloro-2-[[3-methyl-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[3-methyl-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate Traditional Name: 4-chloro-2-[[2-(4-keto-1,2,3-benzotriazin-3-yl)-3-methyl-butanoyl]amino]benzoic acid methyl ester Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)OC)N2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)C(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)OC)N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H19ClN4O4/c1-11(2)17(25-19(27)13-6-4-5-7-15(13)23-24-25)18(26)22-16-10-12(21)8-9-14(16)20(28)29-3/h4-11,17H,1-3H3,(H,22,26)