3-methyl-7-[[methyl-[(E)-3-phenylprop-2-enyl]amino]methyl]-4-oxidanidyl-1-oxidanylidene-N-phenyl-quinoxalin-1-ium-2-carboxamide

Systemtic Name: 3-methyl-7-[[methyl-[(E)-3-phenylprop-2-enyl]amino]methyl]-4-oxidanidyl-1-oxidanylidene-N-phenyl-quinoxalin-1-ium-2-carboxamide Openeye Name: 7-[[[(E)-cinnamyl]-methyl-amino]methyl]-3-methyl-4-oxido-1-oxo-N-phenyl-quinoxalin-1-ium-2-carboxamide CAS Name: 3-methyl-7-[[methyl-[(E)-3-phenylprop-2-enyl]amino]methyl]-4-oxido-1-oxo-N-phenyl-2-quinoxalin-1-iumcarboxamide IUPAC Name: 3-methyl-7-[[methyl-[(E)-3-phenylprop-2-enyl]amino]methyl]-4-oxido-1-oxo-N-phenylquinoxalin-1-ium-2-carboxamide Traditional Name: 7-[[[(E)-cinnamyl]-methyl-amino]methyl]-1-keto-3-methyl-4-oxido-N-phenyl-quinoxalin-1-ium-2-carboxamide Formula: C27H26N4O3 MolecularWeight: 454.52034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)CN(C)CC=CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)CN(C)C/C=C/C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-20-26(27(32)28-23-13-7-4-8-14-23)31(34)25-18-22(15-16-24(25)30(20)33)19-29(2)17-9-12-21-10-5-3-6-11-21/h3-16,18H,17,19H2,1-2H3,(H,28,32)/b12-9+