(2E)-1-(3-bromanyl-4-methoxy-phenyl)-2-hydroxyimino-6-(1H-imidazol-5-yl)hexan-3-one

Systemtic Name: (2E)-1-(3-bromanyl-4-methoxy-phenyl)-2-hydroxyimino-6-(1H-imidazol-5-yl)hexan-3-one Openeye Name: (2E)-1-(3-bromo-4-methoxy-phenyl)-2-hydroxyimino-6-(1H-imidazol-5-yl)hexan-3-one CAS Name: (2E)-1-(3-bromo-4-methoxyphenyl)-2-hydroxyimino-6-(1H-imidazol-5-yl)-3-hexanone IUPAC Name: (2E)-1-(3-bromo-4-methoxyphenyl)-2-hydroxyimino-6-(1H-imidazol-5-yl)hexan-3-one Traditional Name: (2E)-1-(3-bromo-4-methoxy-phenyl)-2-hydroximino-6-(1H-imidazol-5-yl)hexan-3-one Formula: C16H18BrN3O3 MolecularWeight: 380.23642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=NO)C(=O)CCCC2=CN=CN2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C/C(=N\O)/C(=O)CCCC2=CN=CN2)Br

InChI

InChI=1S/C16H18BrN3O3/c1-23-16-6-5-11(7-13(16)17)8-14(20-22)15(21)4-2-3-12-9-18-10-19-12/h5-7,9-10,22H,2-4,8H2,1H3,(H,18,19)/b20-14+