propan-2-yl 3-(4-methylphenyl)-3-[3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(4-methylphenyl)-3-[3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoylamino]propanoate Openeye Name: isopropyl 3-[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoylamino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-3-[[1-oxo-3-(4-oxo-1,2,3-benzotriazin-3-yl)propyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(4-methylphenyl)-3-[3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoylamino]propanoate Traditional Name: 3-[3-(4-keto-1,2,3-benzotriazin-3-yl)propanoylamino]-3-(p-tolyl)propionic acid isopropyl ester Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC(C)C)NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C23H26N4O4/c1-15(2)31-22(29)14-20(17-10-8-16(3)9-11-17)24-21(28)12-13-27-23(30)18-6-4-5-7-19(18)25-26-27/h4-11,15,20H,12-14H2,1-3H3,(H,24,28)