(5R)-N-(5-bromanyl-2-oxidanyl-phenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: (5R)-N-(5-bromanyl-2-oxidanyl-phenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: (5R)-N-(5-bromo-2-hydroxy-phenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: (5R)-N-(5-bromo-2-hydroxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: (5R)-N-(5-bromo-2-hydroxyphenyl)-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: (5R)-N-(5-bromo-2-hydroxy-phenyl)-3-(3,4-dimethoxyphenyl)-2-isoxazoline-5-carboxamide Formula: C18H17BrN2O5 MolecularWeight: 421.24198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(C2)C(=O)NC3=C(C=CC(=C3)Br)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NO[C@H](C2)C(=O)NC3=C(C=CC(=C3)Br)O)OC

InChI

InChI=1S/C18H17BrN2O5/c1-24-15-6-3-10(7-16(15)25-2)12-9-17(26-21-12)18(23)20-13-8-11(19)4-5-14(13)22/h3-8,17,22H,9H2,1-2H3,(H,20,23)/t17-/m1/s1