(4-oxidanylidene-1,2,3-benzotriazin-3-yl) 2-[2-(3,5-dimethoxyphenyl)propan-2-ylamino]propanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl) 2-[2-(3,5-dimethoxyphenyl)propan-2-ylamino]propanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl) 2-[[1-(3,5-dimethoxyphenyl)-1-methyl-ethyl]amino]propanoate CAS Name: 2-[2-(3,5-dimethoxyphenyl)propan-2-ylamino]propanoic acid (4-oxo-1,2,3-benzotriazin-3-yl) ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl) 2-[2-(3,5-dimethoxyphenyl)propan-2-ylamino]propanoate Traditional Name: 2-[[1-(3,5-dimethoxyphenyl)-1-methyl-ethyl]amino]propionic acid (4-keto-1,2,3-benzotriazin-3-yl) ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)ON1C(=O)C2=CC=CC=C2N=N1)NC(C)(C)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C(=O)ON1C(=O)C2=CC=CC=C2N=N1)NC(C)(C)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H24N4O5/c1-13(22-21(2,3)14-10-15(28-4)12-16(11-14)29-5)20(27)30-25-19(26)17-8-6-7-9-18(17)23-24-25/h6-13,22H,1-5H3