N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-4-keto-butyl]adamantane-1-carboxamide Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C24H32N2O4/c27-22(26-14-19-15-29-20-4-1-2-5-21(20)30-19)6-3-7-25-23(28)24-11-16-8-17(12-24)10-18(9-16)13-24/h1-2,4-5,16-19H,3,6-15H2,(H,25,28)(H,26,27)