2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C21H20N4O4/c26-19(13-25-20(27)15-6-2-3-7-16(15)23-24-25)22-14-8-9-17-18(12-14)29-21(28-17)10-4-1-5-11-21/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,22,26)