3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-oxidanyl-2-adamantyl)propanamide

Systemtic Name: 3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-oxidanyl-2-adamantyl)propanamide Openeye Name: 3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-hydroxy-2-adamantyl)propanamide CAS Name: 3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-hydroxy-2-adamantyl)propanamide IUPAC Name: 3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-hydroxy-2-adamantyl)propanamide Traditional Name: 3-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-hydroxy-2-adamantyl)propionamide Formula: C25H36N2O4 MolecularWeight: 428.56434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CCC(=O)NC3C4CC5CC3CC(C5)(C4)O

Isomeric SMILES

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CCC(=O)NC3C4CC5CC3CC(C5)(C4)O

InChI

InChI=1S/C25H36N2O4/c1-3-20-15-27(14-19-10-21(30-2)4-5-22(19)31-20)7-6-23(28)26-24-17-8-16-9-18(24)13-25(29,11-16)12-17/h4-5,10,16-18,20,24,29H,3,6-9,11-15H2,1-2H3,(H,26,28)