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

Systemtic Name: [1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate Openeye Name: [2-(2-furylmethylamino)-1-methyl-2-oxo-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-(2-furanylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(furan-2-ylmethylamino)-1-oxopropan-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-(2-furfurylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)OC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)OC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H18N4O5/c1-12(17(24)19-11-13-5-4-10-26-13)27-16(23)8-9-22-18(25)14-6-2-3-7-15(14)20-21-22/h2-7,10,12H,8-9,11H2,1H3,(H,19,24)