N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-(homopiperonylamino)-2-keto-ethyl]adamantane-1-carboxamide Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H28N2O4/c25-20(23-4-3-14-1-2-18-19(8-14)28-13-27-18)12-24-21(26)22-9-15-5-16(10-22)7-17(6-15)11-22/h1-2,8,15-17H,3-7,9-13H2,(H,23,25)(H,24,26)