N-[2-(2-methylpropoxy)phenyl]-2,4-dinitro-aniline

Systemtic Name: N-[2-(2-methylpropoxy)phenyl]-2,4-dinitro-aniline Openeye Name: N-(2-isobutoxyphenyl)-2,4-dinitro-aniline CAS Name: N-[2-(2-methylpropoxy)phenyl]-2,4-dinitroaniline IUPAC Name: N-[2-(2-methylpropoxy)phenyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-(2-isobutoxyphenyl)amine Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=CC=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O5/c1-11(2)10-24-16-6-4-3-5-14(16)17-13-8-7-12(18(20)21)9-15(13)19(22)23/h3-9,11,17H,10H2,1-2H3