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(3-cyanophenyl)methyl 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate

(3-cyanophenyl)methyl 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate

Systemtic Name:(3-cyanophenyl)methyl 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate
Openeye Name:(3-cyanophenyl)methyl 4-(5-bromo-2-methoxy-phenyl)-4-oxo-butanoate
CAS Name:4-(5-bromo-2-methoxyphenyl)-4-oxobutanoic acid (3-cyanophenyl)methyl ester
IUPAC Name:(3-cyanophenyl)methyl 4-(5-bromo-2-methoxyphenyl)-4-oxobutanoate
Traditional Name:4-(5-bromo-2-methoxy-phenyl)-4-keto-butyric acid (3-cyanobenzyl) ester
Formula: C19H16BrNO4
MolecularWeight: 402.23864
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OCC2=CC=CC(=C2)C#N


Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OCC2=CC=CC(=C2)C#N


InChI

InChI=1S/C19H16BrNO4/c1-24-18-7-5-15(20)10-16(18)17(22)6-8-19(23)25-12-14-4-2-3-13(9-14)11-21/h2-5,7,9-10H,6,8,12H2,1H3


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