N-cyclohexyl-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-prop-2-ynyl-ethanamide Openeye Name: N-cyclohexyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-prop-2-ynyl-acetamide CAS Name: N-cyclohexyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)-2-piperazin-1-iumyl]-N-prop-2-ynylacetamide IUPAC Name: N-cyclohexyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-prop-2-ynylacetamide Traditional Name: N-cyclohexyl-2-[(2R)-3-keto-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-propargyl-acetamide Formula: C24H34N3O2+ MolecularWeight: 396.54566

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1CCCCC1)C(=O)CC2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

Isomeric SMILES

C#CCN(C1CCCCC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O2/c1-2-16-27(21-13-7-4-8-14-21)23(28)19-22-24(29)25-15-18-26(22)17-9-12-20-10-5-3-6-11-20/h1,3,5-6,10-11,21-22H,4,7-9,12-19H2,(H,25,29)/p+1/t22-/m1/s1