N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenyl-acetamide CAS Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-phenylacetamide Traditional Name: N-(3-keto-2-methyl-4-piperonyl-5H-1,4-benzoxazepin-7-yl)-2-phenyl-acetamide 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)CC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5

InChI

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