2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]ethanamide Openeye Name: 2-[(2R)-1-indan-2-yl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide CAS Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-[(1-methyl-4-pyrazolyl)methyl]acetamide IUPAC Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide Traditional Name: 2-[(2R)-1-indan-2-yl-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)C(=O)CC2C(=O)NCC[NH+]2C3CC4=CC=CC=C4C3

Isomeric SMILES

CN1C=C(C=N1)CN(C)C(=O)C[C@@H]2C(=O)NCC[NH+]2C3CC4=CC=CC=C4C3

InChI

InChI=1S/C21H27N5O2/c1-24(13-15-12-23-25(2)14-15)20(27)11-19-21(28)22-7-8-26(19)18-9-16-5-3-4-6-17(16)10-18/h3-6,12,14,18-19H,7-11,13H2,1-2H3,(H,22,28)/p+1/t19-/m1/s1