2-(4-bromanylphenoxy)-N-(4-methoxy-3,5-dinitro-phenyl)-2-methyl-propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-(4-methoxy-3,5-dinitro-phenyl)-2-methyl-propanamide Openeye Name: 2-(4-bromophenoxy)-N-(4-methoxy-3,5-dinitro-phenyl)-2-methyl-propanamide CAS Name: 2-(4-bromophenoxy)-N-(4-methoxy-3,5-dinitrophenyl)-2-methylpropanamide IUPAC Name: 2-(4-bromophenoxy)-N-(4-methoxy-3,5-dinitrophenyl)-2-methylpropanamide Traditional Name: 2-(4-bromophenoxy)-N-(4-methoxy-3,5-dinitro-phenyl)-2-methyl-propionamide Formula: C17H16BrN3O7 MolecularWeight: 454.22884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])OC)[N+](=O)[O-])OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])OC)[N+](=O)[O-])OC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H16BrN3O7/c1-17(2,28-12-6-4-10(18)5-7-12)16(22)19-11-8-13(20(23)24)15(27-3)14(9-11)21(25)26/h4-9H,1-3H3,(H,19,22)