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

Systemtic Name: 1-[2-oxidanylidene-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]ethyl]quinoxalin-2-one Openeye Name: 1-[2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]quinoxalin-2-one CAS Name: 1-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]ethyl]-2-quinoxalinone IUPAC Name: 1-[2-oxo-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]ethyl]quinoxalin-2-one Traditional Name: 1-[2-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-2-keto-ethyl]quinoxalin-2-one Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4N=CC3=O

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4N=CC3=O

InChI

InChI=1S/C23H24N4O2/c28-22-17-24-20-10-4-5-11-21(20)27(22)18-23(29)26-15-13-25(14-16-26)12-6-9-19-7-2-1-3-8-19/h1-11,17H,12-16,18H2/p+1/b9-6+