N-(2-methyl-3-oxidanylidene-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-methyl-3-oxidanylidene-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-1,3-benzodioxole-5-carboxamide CAS Name: N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-methyl-3-oxo-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(3-keto-2-methyl-4-phenethyl-5H-1,4-benzoxazepin-7-yl)-piperonylamide Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CCC5=CC=CC=C5

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CCC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O5/c1-17-26(30)28(12-11-18-5-3-2-4-6-18)15-20-13-21(8-10-22(20)33-17)27-25(29)19-7-9-23-24(14-19)32-16-31-23/h2-10,13-14,17H,11-12,15-16H2,1H3,(H,27,29)