1-adamantyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Openeye Name: 1-adamantyl-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methanone CAS Name: 1-adamantyl-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: 1-adamantyl-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Traditional Name: 1-adamantyl-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methanone Formula: C24H33N2O+ MolecularWeight: 365.53162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32N2O/c27-23(24-16-20-13-21(17-24)15-22(14-20)18-24)26-11-9-25(10-12-26)8-4-7-19-5-2-1-3-6-19/h1-7,20-22H,8-18H2/p+1/b7-4+