1-(5-bromanyl-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitro-phenyl)ethanone

Systemtic Name: 1-(5-bromanyl-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitro-phenyl)ethanone Openeye Name: 1-(5-bromo-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitro-phenyl)ethanone CAS Name: 1-(5-bromo-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitrophenyl)ethanone IUPAC Name: 1-(5-bromo-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitrophenyl)ethanone Traditional Name: 1-(5-bromo-1H-indol-3-yl)-2-(4,5-dimethoxy-2-nitro-phenyl)ethanone Formula: C18H15BrN2O5 MolecularWeight: 419.2261

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)C2=CNC3=C2C=C(C=C3)Br)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)C2=CNC3=C2C=C(C=C3)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C18H15BrN2O5/c1-25-17-6-10(15(21(23)24)8-18(17)26-2)5-16(22)13-9-20-14-4-3-11(19)7-12(13)14/h3-4,6-9,20H,5H2,1-2H3