1-[4-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[2-(4-bromophenoxy)ethyl-methyl-amino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[2-(4-bromophenoxy)ethyl-methylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[2-(4-bromophenoxy)ethyl-methylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[2-(4-bromophenoxy)ethyl-methyl-amino]-3-nitro-phenyl]ethanone Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N(C)CCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N(C)CCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H17BrN2O4/c1-12(21)13-3-8-16(17(11-13)20(22)23)19(2)9-10-24-15-6-4-14(18)5-7-15/h3-8,11H,9-10H2,1-2H3