N-(1-adamantyl)-2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanamide

Systemtic Name: N-(1-adamantyl)-2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)ethanamide Openeye Name: N-(1-adamantyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide CAS Name: N-(1-adamantyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide IUPAC Name: N-(1-adamantyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CC(=O)NC34CC5CC(C3)CC(C5)C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CC(=O)NC34CC5CC(C3)CC(C5)C4)Cl)OC1

InChI

InChI=1S/C21H26ClNO3/c22-17-7-13(8-18-20(17)26-3-1-2-25-18)9-19(24)23-21-10-14-4-15(11-21)6-16(5-14)12-21/h7-8,14-16H,1-6,9-12H2,(H,23,24)