cyclohexyl-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethyl]azanium

Systemtic Name: cyclohexyl-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethyl]azanium Openeye Name: cyclohexyl-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethyl]ammonium CAS Name: cyclohexyl-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethyl]ammonium IUPAC Name: cyclohexyl-[2-[4-[(3-nitrophenyl)methylamino]phenyl]ethyl]azanium Traditional Name: cyclohexyl-[2-[4-[(3-nitrobenzyl)amino]phenyl]ethyl]ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH2+]CCC2=CC=C(C=C2)NCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH2+]CCC2=CC=C(C=C2)NCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O2/c25-24(26)21-8-4-5-18(15-21)16-23-20-11-9-17(10-12-20)13-14-22-19-6-2-1-3-7-19/h4-5,8-12,15,19,22-23H,1-3,6-7,13-14,16H2/p+1