N-(4-methylphenyl)-2-[(2R)-3-oxidanylidene-1-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]piperazin-2-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[(2R)-3-oxidanylidene-1-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)ethanoyl]piperazin-2-yl]ethanamide Openeye Name: 2-[(2R)-3-oxo-1-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]piperazin-2-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[(2R)-3-oxo-1-[1-oxo-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]ethyl]-2-piperazinyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[(2R)-3-oxo-1-[2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)acetyl]piperazin-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-[2-[4-(2-pyridyl)piperazin-1-ium-1-yl]acetyl]piperazin-2-yl]-N-(p-tolyl)acetamide Formula: C24H31N6O3+ MolecularWeight: 451.54134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[C@@H]2C(=O)NCCN2C(=O)C[NH+]3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H30N6O3/c1-18-5-7-19(8-6-18)27-22(31)16-20-24(33)26-10-11-30(20)23(32)17-28-12-14-29(15-13-28)21-4-2-3-9-25-21/h2-9,20H,10-17H2,1H3,(H,26,33)(H,27,31)/p+1/t20-/m1/s1