[4-(1-adamantylcarbonyl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone

Systemtic Name: [4-(1-adamantylcarbonyl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone Openeye Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone CAS Name: [4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-(2,3-diethyl-6-quinoxalinyl)methanone IUPAC Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(2,3-diethylquinoxalin-6-yl)methanone Traditional Name: [4-(adamantane-1-carbonyl)piperazino]-(2,3-diethylquinoxalin-6-yl)methanone Formula: C28H36N4O2 MolecularWeight: 460.61104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)N=C1CC

InChI

InChI=1S/C28H36N4O2/c1-3-22-23(4-2)30-25-14-21(5-6-24(25)29-22)26(33)31-7-9-32(10-8-31)27(34)28-15-18-11-19(16-28)13-20(12-18)17-28/h5-6,14,18-20H,3-4,7-13,15-17H2,1-2H3