cyclohexyl-[[2-[(2-methoxy-5-nitro-phenyl)methylamino]phenyl]methyl]-methyl-azanium

Systemtic Name: cyclohexyl-[[2-[(2-methoxy-5-nitro-phenyl)methylamino]phenyl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[2-[(2-methoxy-5-nitro-phenyl)methylamino]phenyl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[2-[(2-methoxy-5-nitrophenyl)methylamino]phenyl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[2-[(2-methoxy-5-nitrophenyl)methylamino]phenyl]methyl]-methylazanium Traditional Name: cyclohexyl-[2-[(2-methoxy-5-nitro-benzyl)amino]benzyl]-methyl-ammonium Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1NCC2=C(C=CC(=C2)[N+](=O)[O-])OC)C3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1NCC2=C(C=CC(=C2)[N+](=O)[O-])OC)C3CCCCC3

InChI

InChI=1S/C22H29N3O3/c1-24(19-9-4-3-5-10-19)16-17-8-6-7-11-21(17)23-15-18-14-20(25(26)27)12-13-22(18)28-2/h6-8,11-14,19,23H,3-5,9-10,15-16H2,1-2H3/p+1