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

Systemtic Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-indan-2-yl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(2R)-1-(2,3-dihydro-1H-inden-2-yl)-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(2R)-1-indan-2-yl-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(3-pyridylmethyl)acetamide Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=CC=C1)C(=O)CC2C(=O)NCC[NH+]2C3CC4=CC=CC=C4C3

Isomeric SMILES

CN(CC1=CN=CC=C1)C(=O)C[C@@H]2C(=O)NCC[NH+]2C3CC4=CC=CC=C4C3

InChI

InChI=1S/C22H26N4O2/c1-25(15-16-5-4-8-23-14-16)21(27)13-20-22(28)24-9-10-26(20)19-11-17-6-2-3-7-18(17)12-19/h2-8,14,19-20H,9-13,15H2,1H3,(H,24,28)/p+1/t20-/m1/s1