2-[4-bromanyl-2-[[2-[(4-nitrophenyl)amino]ethylamino]methyl]phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-bromanyl-2-[[2-[(4-nitrophenyl)amino]ethylamino]methyl]phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[4-bromo-2-[[2-(4-nitroanilino)ethylamino]methyl]phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[4-bromo-2-[[2-(4-nitroanilino)ethylamino]methyl]phenoxy]-N-tert-butylacetamide IUPAC Name: 2-[4-bromo-2-[[2-(4-nitroanilino)ethylamino]methyl]phenoxy]-N-tert-butylacetamide Traditional Name: 2-[4-bromo-2-[[2-(4-nitroanilino)ethylamino]methyl]phenoxy]-N-tert-butyl-acetamide Formula: C21H27BrN4O4 MolecularWeight: 479.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27BrN4O4/c1-21(2,3)25-20(27)14-30-19-9-4-16(22)12-15(19)13-23-10-11-24-17-5-7-18(8-6-17)26(28)29/h4-9,12,23-24H,10-11,13-14H2,1-3H3,(H,25,27)