4-[4-(1-adamantyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(1-adamantyl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(1-adamantyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(1-adamantyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(1-adamantyl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(1-adamantyl)piperazino]-4-keto-butyric acid Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H28N2O3/c21-16(1-2-17(22)23)19-3-5-20(6-4-19)18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,1-12H2,(H,22,23)