2-methyl-4-nitro-N-octadecyl-aniline

Systemtic Name: 2-methyl-4-nitro-N-octadecyl-aniline Openeye Name: 2-methyl-4-nitro-N-octadecyl-aniline CAS Name: 2-methyl-4-nitro-N-octadecylaniline IUPAC Name: 2-methyl-4-nitro-N-octadecylaniline Traditional Name: (2-methyl-4-nitro-phenyl)-stearyl-amine Formula: C25H44N2O2 MolecularWeight: 404.62906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=C(C=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C25H44N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26-25-20-19-24(27(28)29)22-23(25)2/h19-20,22,26H,3-18,21H2,1-2H3