[2-bromanyl-3-(2-methoxyethoxy)-4-methylsulfonyl-phenyl]-[5-(1-methylcyclopropyl)-1,2-oxazol-3-yl]methanone

Systemtic Name: [2-bromanyl-3-(2-methoxyethoxy)-4-methylsulfonyl-phenyl]-[5-(1-methylcyclopropyl)-1,2-oxazol-3-yl]methanone Openeye Name: [2-bromo-3-(2-methoxyethoxy)-4-methylsulfonyl-phenyl]-[5-(1-methylcyclopropyl)isoxazol-3-yl]methanone CAS Name: [2-bromo-3-(2-methoxyethoxy)-4-methylsulfonylphenyl]-[5-(1-methylcyclopropyl)-3-isoxazolyl]methanone IUPAC Name: [2-bromo-3-(2-methoxyethoxy)-4-methylsulfonylphenyl]-[5-(1-methylcyclopropyl)-1,2-oxazol-3-yl]methanone Traditional Name: [2-bromo-4-mesyl-3-(2-methoxyethoxy)phenyl]-[5-(1-methylcyclopropyl)isoxazol-3-yl]methanone Formula: C18H20BrNO6S MolecularWeight: 458.3235

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)C2=CC(=NO2)C(=O)C3=C(C(=C(C=C3)S(=O)(=O)C)OCCOC)Br

Isomeric SMILES

CC1(CC1)C2=CC(=NO2)C(=O)C3=C(C(=C(C=C3)S(=O)(=O)C)OCCOC)Br

InChI

InChI=1S/C18H20BrNO6S/c1-18(6-7-18)14-10-12(20-26-14)16(21)11-4-5-13(27(3,22)23)17(15(11)19)25-9-8-24-2/h4-5,10H,6-9H2,1-3H3