1-adamantyl-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(2,3,4-trimethoxybenzyl)piperazino]methanone Formula: C25H36N2O4 MolecularWeight: 428.56434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)OC)OC

InChI

InChI=1S/C25H36N2O4/c1-29-21-5-4-20(22(30-2)23(21)31-3)16-26-6-8-27(9-7-26)24(28)25-13-17-10-18(14-25)12-19(11-17)15-25/h4-5,17-19H,6-16H2,1-3H3