1-[4-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-3-nitro-phenyl]ethanone Formula: C17H17BrN2O4 MolecularWeight: 393.23188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N(C)CC2=C(C=CC(=C2)Br)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N(C)CC2=C(C=CC(=C2)Br)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H17BrN2O4/c1-11(21)12-4-6-15(16(9-12)20(22)23)19(2)10-13-8-14(18)5-7-17(13)24-3/h4-9H,10H2,1-3H3