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

Systemtic Name: methyl 4-[[(2R)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate Openeye Name: methyl 4-[[(2R)-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate CAS Name: 4-[[(2R)-1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-2-(4-oxo-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoate Traditional Name: 4-[[(2R)-2-(4-keto-1,2,3-benzotriazin-3-yl)butanoyl]amino]benzoic acid methyl ester Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H18N4O4/c1-3-16(23-18(25)14-6-4-5-7-15(14)21-22-23)17(24)20-13-10-8-12(9-11-13)19(26)27-2/h4-11,16H,3H2,1-2H3,(H,20,24)/t16-/m1/s1