(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoate CAS Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 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-7-methoxy-chromen-4-yl)methyl ester Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H17N3O6/c1-28-14-6-7-15-13(10-20(26)30-18(15)11-14)12-29-19(25)8-9-24-21(27)16-4-2-3-5-17(16)22-23-24/h2-7,10-11H,8-9,12H2,1H3