N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-[(2R)-1-(1-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-2-[(2R)-1-(1-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-[(2R)-3-keto-1-(1-naphthylmethyl)piperazin-1-ium-2-yl]acetamide Formula: C25H32N5O2+ MolecularWeight: 434.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H31N5O2/c1-4-30-18(3)22(17(2)28-30)15-27-24(31)14-23-25(32)26-12-13-29(23)16-20-10-7-9-19-8-5-6-11-21(19)20/h5-11,23H,4,12-16H2,1-3H3,(H,26,32)(H,27,31)/p+1/t23-/m1/s1