3-(5-bromanylthiophen-2-yl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(5-bromanylthiophen-2-yl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-3-oxidanylidene-propanoic acid Openeye Name: 3-(5-bromo-2-thienyl)-2-(5-methyl-2-phenyl-oxazol-4-yl)-3-oxo-propanoic acid CAS Name: 3-(5-bromo-2-thiophenyl)-2-(5-methyl-2-phenyl-4-oxazolyl)-3-oxopropanoic acid IUPAC Name: 3-(5-bromothiophen-2-yl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-3-oxopropanoic acid Traditional Name: 3-(5-bromo-2-thienyl)-3-keto-2-(5-methyl-2-phenyl-oxazol-4-yl)propionic acid Formula: C17H12BrNO4S MolecularWeight: 406.25048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)C(C(=O)C3=CC=C(S3)Br)C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)C(C(=O)C3=CC=C(S3)Br)C(=O)O

InChI

InChI=1S/C17H12BrNO4S/c1-9-14(19-16(23-9)10-5-3-2-4-6-10)13(17(21)22)15(20)11-7-8-12(18)24-11/h2-8,13H,1H3,(H,21,22)