N1,N4-bis(2-methyl-2-nitro-octyl)benzene-1,4-diamine

Systemtic Name: N1,N4-bis(2-methyl-2-nitro-octyl)benzene-1,4-diamine Openeye Name: N1,N4-bis(2-methyl-2-nitro-octyl)benzene-1,4-diamine CAS Name: N1,N4-bis(2-methyl-2-nitrooctyl)benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis(2-methyl-2-nitrooctyl)benzene-1,4-diamine Traditional Name: (2-methyl-2-nitro-octyl)-[4-[(2-methyl-2-nitro-octyl)amino]phenyl]amine Formula: C24H42N4O4 MolecularWeight: 450.61468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(CNC1=CC=C(C=C1)NCC(C)(CCCCCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(C)(CNC1=CC=C(C=C1)NCC(C)(CCCCCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H42N4O4/c1-5-7-9-11-17-23(3,27(29)30)19-25-21-13-15-22(16-14-21)26-20-24(4,28(31)32)18-12-10-8-6-2/h13-16,25-26H,5-12,17-20H2,1-4H3