[4-(1-adamantylcarbonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone

Systemtic Name: [4-(1-adamantylcarbonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone Openeye Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone CAS Name: [4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-(1,3-benzodioxol-5-yl)methanone IUPAC Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(1,3-benzodioxol-5-yl)methanone Traditional Name: [4-(adamantane-1-carbonyl)piperazino]-(1,3-benzodioxol-5-yl)methanone Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H28N2O4/c26-21(18-1-2-19-20(10-18)29-14-28-19)24-3-5-25(6-4-24)22(27)23-11-15-7-16(12-23)9-17(8-15)13-23/h1-2,10,15-17H,3-9,11-14H2