N-[(3-nitrophenyl)methyl]-1-[3-[[(3-nitrophenyl)methylamino]methyl]cyclohexyl]methanamine

Systemtic Name: N-[(3-nitrophenyl)methyl]-1-[3-[[(3-nitrophenyl)methylamino]methyl]cyclohexyl]methanamine Openeye Name: N-[(3-nitrophenyl)methyl]-1-[3-[[(3-nitrophenyl)methylamino]methyl]cyclohexyl]methanamine CAS Name: N-[(3-nitrophenyl)methyl]-1-[3-[[(3-nitrophenyl)methylamino]methyl]cyclohexyl]methanamine IUPAC Name: N-[(3-nitrophenyl)methyl]-1-[3-[[(3-nitrophenyl)methylamino]methyl]cyclohexyl]methanamine Traditional Name: (3-nitrobenzyl)-[[3-[[(3-nitrobenzyl)amino]methyl]cyclohexyl]methyl]amine Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNCC2=CC(=CC=C2)[N+](=O)[O-])CNCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CC(C1)CNCC2=CC(=CC=C2)[N+](=O)[O-])CNCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c27-25(28)21-8-2-6-19(11-21)15-23-13-17-4-1-5-18(10-17)14-24-16-20-7-3-9-22(12-20)26(29)30/h2-3,6-9,11-12,17-18,23-24H,1,4-5,10,13-16H2