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

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoate CAS Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoate Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)propionic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)CCN1C(=O)C2=CC=CC=C2N=N1

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)CCN1C(=O)C2=CC=CC=C2N=N1

InChI

InChI=1S/C16H20N4O4/c1-3-9-17-15(22)11(2)24-14(21)8-10-20-16(23)12-6-4-5-7-13(12)18-19-20/h4-7,11H,3,8-10H2,1-2H3,(H,17,22)