(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H18N4O3/c27-21-16-9-3-6-12-19(16)24-25-26(21)13-29-22(28)20-14-7-1-4-10-17(14)23-18-11-5-2-8-15(18)20/h1,3-4,6-7,9-10,12H,2,5,8,11,13H2