6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 6-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1,4-dihydroquinoxaline-2,3-dione CAS Name: 6-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 6-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbonyl]-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 6-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1,4-dihydroquinoxaline-2,3-quinone Formula: C22H23N4O3+ MolecularWeight: 391.44302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)NC(=O)C(=O)N4

InChI

InChI=1S/C22H22N4O3/c27-20-21(28)24-19-15-17(8-9-18(19)23-20)22(29)26-13-11-25(12-14-26)10-4-7-16-5-2-1-3-6-16/h1-9,15H,10-14H2,(H,23,27)(H,24,28)/p+1/b7-4+