N-(1-adamantylmethyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(1-adamantylmethyl)-2-(4-benzoyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide Formula: C24H34N3O2+ MolecularWeight: 396.54566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H33N3O2/c28-22(25-17-24-13-18-10-19(14-24)12-20(11-18)15-24)16-26-6-8-27(9-7-26)23(29)21-4-2-1-3-5-21/h1-5,18-20H,6-17H2,(H,25,28)/p+1