[2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate

Systemtic Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate Openeye Name: [2-(3-methylbenzofuran-2-yl)-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 [2-(3-methyl-2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxoethyl] 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-2-(3-methylbenzofuran-2-yl)ethyl] ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H17N3O5/c1-13-14-6-3-5-9-18(14)29-20(13)17(25)12-28-19(26)10-11-24-21(27)15-7-2-4-8-16(15)22-23-24/h2-9H,10-12H2,1H3