N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(2-chlorobenzyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]-piperonylamide Formula: C26H23ClN2O5 MolecularWeight: 478.92422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5Cl

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C26H23ClN2O5/c1-2-21-26(31)29(13-17-5-3-4-6-20(17)27)14-18-11-19(8-10-22(18)34-21)28-25(30)16-7-9-23-24(12-16)33-15-32-23/h3-12,21H,2,13-15H2,1H3,(H,28,30)