methyl 3-[5-(4-bromophenyl)-1,2-oxazol-3-yl]-4-ethanoyl-2-methylidene-5-oxidanylidene-hexanoate

Systemtic Name: methyl 3-[5-(4-bromophenyl)-1,2-oxazol-3-yl]-4-ethanoyl-2-methylidene-5-oxidanylidene-hexanoate Openeye Name: methyl 4-acetyl-3-[5-(4-bromophenyl)isoxazol-3-yl]-2-methylene-5-oxo-hexanoate CAS Name: 4-acetyl-3-[5-(4-bromophenyl)-3-isoxazolyl]-2-methylene-5-oxohexanoic acid methyl ester IUPAC Name: methyl 4-acetyl-3-[5-(4-bromophenyl)-1,2-oxazol-3-yl]-2-methylidene-5-oxohexanoate Traditional Name: 2-[2-acetyl-1-[5-(4-bromophenyl)isoxazol-3-yl]-3-keto-butyl]acrylic acid methyl ester Formula: C19H18BrNO5 MolecularWeight: 420.25392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=NOC(=C1)C2=CC=C(C=C2)Br)C(=C)C(=O)OC)C(=O)C

Isomeric SMILES

CC(=O)C(C(C1=NOC(=C1)C2=CC=C(C=C2)Br)C(=C)C(=O)OC)C(=O)C

InChI

InChI=1S/C19H18BrNO5/c1-10(19(24)25-4)17(18(11(2)22)12(3)23)15-9-16(26-21-15)13-5-7-14(20)8-6-13/h5-9,17-18H,1H2,2-4H3