4-(5-bromanyl-5-nitro-1,3-dioxan-2-yl)-N,N-diethyl-aniline

Systemtic Name: 4-(5-bromanyl-5-nitro-1,3-dioxan-2-yl)-N,N-diethyl-aniline Openeye Name: 4-(5-bromo-5-nitro-1,3-dioxan-2-yl)-N,N-diethyl-aniline CAS Name: 4-(5-bromo-5-nitro-1,3-dioxan-2-yl)-N,N-diethylaniline IUPAC Name: 4-(5-bromo-5-nitro-1,3-dioxan-2-yl)-N,N-diethylaniline Traditional Name: [4-(5-bromo-5-nitro-1,3-dioxan-2-yl)phenyl]-diethyl-amine Formula: C14H19BrN2O4 MolecularWeight: 359.21566

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2OCC(CO2)([N+](=O)[O-])Br

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2OCC(CO2)([N+](=O)[O-])Br

InChI

InChI=1S/C14H19BrN2O4/c1-3-16(4-2)12-7-5-11(6-8-12)13-20-9-14(15,10-21-13)17(18)19/h5-8,13H,3-4,9-10H2,1-2H3