diethyl-[[2-methoxy-5-[(Z)-C-methyl-N-[(3-nitrophenyl)carbonylamino]carbonimidoyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-methoxy-5-[(Z)-C-methyl-N-[(3-nitrophenyl)carbonylamino]carbonimidoyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-methoxy-5-[(Z)-C-methyl-N-[(3-nitrobenzoyl)amino]carbonimidoyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-methoxy-5-[(1Z)-1-[[(3-nitrophenyl)-oxomethyl]hydrazinylidene]ethyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-methoxy-5-[(Z)-C-methyl-N-[(3-nitrobenzoyl)amino]carbonimidoyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-methoxy-5-[(Z)-C-methyl-N-[(3-nitrobenzoyl)amino]carbonimidoyl]benzyl]ammonium Formula: C21H27N4O4+ MolecularWeight: 399.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)C(=NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C)OC

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)/C(=N\NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])/C)OC

InChI

InChI=1S/C21H26N4O4/c1-5-24(6-2)14-18-12-16(10-11-20(18)29-4)15(3)22-23-21(26)17-8-7-9-19(13-17)25(27)28/h7-13H,5-6,14H2,1-4H3,(H,23,26)/p+1/b22-15-