(3R)-4-(2,3-dihydro-1H-inden-2-yl)-3-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-(2,3-dihydro-1H-inden-2-yl)-3-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-indan-2-yl-3-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-(2,3-dihydro-1H-inden-2-yl)-3-[2-oxo-2-[4-(2-pyrazinyl)-1-piperazinyl]ethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-(2,3-dihydro-1H-inden-2-yl)-3-[2-oxo-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]piperazin-4-ium-2-one Traditional Name: (3R)-4-indan-2-yl-3-[2-keto-2-(4-pyrazin-2-ylpiperazino)ethyl]piperazin-4-ium-2-one Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)C4CC5=CC=CC=C5C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C23H28N6O2/c30-22(28-11-9-27(10-12-28)21-16-24-5-6-25-21)15-20-23(31)26-7-8-29(20)19-13-17-3-1-2-4-18(17)14-19/h1-6,16,19-20H,7-15H2,(H,26,31)/p+1/t20-/m1/s1