3-(3,5-dinitro-4-phenethyloxy-phenyl)-1,1-dimethyl-urea

Systemtic Name: 3-(3,5-dinitro-4-phenethyloxy-phenyl)-1,1-dimethyl-urea Openeye Name: 3-(3,5-dinitro-4-phenethyloxy-phenyl)-1,1-dimethyl-urea CAS Name: 3-(3,5-dinitro-4-phenethyloxyphenyl)-1,1-dimethylurea IUPAC Name: 3-(3,5-dinitro-4-phenethyloxyphenyl)-1,1-dimethylurea Traditional Name: 3-(3,5-dinitro-4-phenethyloxy-phenyl)-1,1-dimethyl-urea Formula: C17H18N4O6 MolecularWeight: 374.34802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])OCCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])OCCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O6/c1-19(2)17(22)18-13-10-14(20(23)24)16(15(11-13)21(25)26)27-9-8-12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,18,22)