2,4-dinitro-N,N-dioctadecyl-aniline

Systemtic Name: 2,4-dinitro-N,N-dioctadecyl-aniline Openeye Name: 2,4-dinitro-N,N-dioctadecyl-aniline CAS Name: 2,4-dinitro-N,N-dioctadecylaniline IUPAC Name: 2,4-dinitro-N,N-dioctadecylaniline Traditional Name: (2,4-dinitrophenyl)-distearyl-amine Formula: C42H77N3O4 MolecularWeight: 688.07848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C42H77N3O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-43(41-36-35-40(44(46)47)39-42(41)45(48)49)38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39H,3-34,37-38H2,1-2H3