N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3CCC(CC3)CN4C(=O)C5=CC=CC=C5N=N4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3CCC(CC3)CN4C(=O)C5=CC=CC=C5N=N4)OC1

InChI

InChI=1S/C24H26N4O4/c29-23(25-18-10-11-21-22(14-18)32-13-3-12-31-21)17-8-6-16(7-9-17)15-28-24(30)19-4-1-2-5-20(19)26-27-28/h1-2,4-5,10-11,14,16-17H,3,6-9,12-13,15H2,(H,25,29)