cyclohexyl-methyl-[[2-[2-(2-nitrophenyl)ethanoylamino]phenyl]methyl]azanium

Systemtic Name: cyclohexyl-methyl-[[2-[2-(2-nitrophenyl)ethanoylamino]phenyl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)acetyl]amino]phenyl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)-1-oxoethyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[[2-(2-nitrophenyl)acetyl]amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-methyl-[2-[[2-(2-nitrophenyl)acetyl]amino]benzyl]ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C22H27N3O3/c1-24(19-11-3-2-4-12-19)16-18-10-5-7-13-20(18)23-22(26)15-17-9-6-8-14-21(17)25(27)28/h5-10,13-14,19H,2-4,11-12,15-16H2,1H3,(H,23,26)/p+1