N-[2-(2,4-dimethylphenoxy)ethyl]-2,4-dinitro-aniline

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C

InChI

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