(3R)-3-[2-oxidanylidene-2-(4-pyrazin-2-ylpiperazin-1-yl)ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-2-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H28N6O2/c30-22(29-15-13-28(14-16-29)21-18-24-8-9-25-21)17-20-23(31)26-10-12-27(20)11-4-7-19-5-2-1-3-6-19/h1-9,18,20H,10-17H2,(H,26,31)/p+1/b7-4+/t20-/m1/s1