2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 2-adamantyl-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methanone Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3C4CC5CC(C4)CC3C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3C4CC5CC(C4)CC3C5)OC

InChI

InChI=1S/C23H32N2O5S/c1-29-20-4-3-19(14-21(20)30-2)31(27,28)25-7-5-24(6-8-25)23(26)22-17-10-15-9-16(12-17)13-18(22)11-15/h3-4,14-18,22H,5-13H2,1-2H3