cyclohexyl-methyl-[[2-[[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]amino]phenyl]methyl]azanium

Systemtic Name: cyclohexyl-methyl-[[2-[[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]amino]phenyl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[2-[[2-(4-methyl-2-nitro-anilino)-2-oxo-ethyl]amino]phenyl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[2-[[2-(4-methyl-2-nitroanilino)-2-oxoethyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[[2-(4-methyl-2-nitroanilino)-2-oxoethyl]amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-[2-[[2-keto-2-(4-methyl-2-nitro-anilino)ethyl]amino]benzyl]-methyl-ammonium Formula: C23H31N4O3+ MolecularWeight: 411.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CNC2=CC=CC=C2C[NH+](C)C3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CNC2=CC=CC=C2C[NH+](C)C3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O3/c1-17-12-13-21(22(14-17)27(29)30)25-23(28)15-24-20-11-7-6-8-18(20)16-26(2)19-9-4-3-5-10-19/h6-8,11-14,19,24H,3-5,9-10,15-16H2,1-2H3,(H,25,28)/p+1