[4-(1-adamantyl)piperazin-1-yl]-[5-[(4-ethoxyphenoxy)methyl]furan-2-yl]methanone

Systemtic Name: [4-(1-adamantyl)piperazin-1-yl]-[5-[(4-ethoxyphenoxy)methyl]furan-2-yl]methanone Openeye Name: [4-(1-adamantyl)piperazin-1-yl]-[5-[(4-ethoxyphenoxy)methyl]-2-furyl]methanone CAS Name: [4-(1-adamantyl)-1-piperazinyl]-[5-[(4-ethoxyphenoxy)methyl]-2-furanyl]methanone IUPAC Name: [4-(1-adamantyl)piperazin-1-yl]-[5-[(4-ethoxyphenoxy)methyl]furan-2-yl]methanone Traditional Name: [4-(1-adamantyl)piperazino]-[5-[(4-ethoxyphenoxy)methyl]-2-furyl]methanone Formula: C28H36N2O4 MolecularWeight: 464.59644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H36N2O4/c1-2-32-23-3-5-24(6-4-23)33-19-25-7-8-26(34-25)27(31)29-9-11-30(12-10-29)28-16-20-13-21(17-28)15-22(14-20)18-28/h3-8,20-22H,2,9-19H2,1H3