3-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]adamantane-1-carboxamide Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C21H26ClNO3/c22-21-11-15-7-16(12-21)10-20(9-15,13-21)19(24)23-4-3-14-1-2-17-18(8-14)26-6-5-25-17/h1-2,8,15-16H,3-7,9-13H2,(H,23,24)