3-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)adamantane-1-carboxamide Openeye Name: 3-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)adamantane-1-carboxamide CAS Name: 3-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)adamantane-1-carboxamide Traditional Name: 3-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)adamantane-1-carboxamide Formula: C20H24ClNO3 MolecularWeight: 361.86246

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)OC1

InChI

InChI=1S/C20H24ClNO3/c21-20-10-13-6-14(11-20)9-19(8-13,12-20)18(23)22-15-2-3-16-17(7-15)25-5-1-4-24-16/h2-3,7,13-14H,1,4-6,8-12H2,(H,22,23)