[2-bromanyl-3-cyano-4-(2-cyanophenyl)phenyl]methyl ethanoate

Systemtic Name: [2-bromanyl-3-cyano-4-(2-cyanophenyl)phenyl]methyl ethanoate Openeye Name: [2-bromo-3-cyano-4-(2-cyanophenyl)phenyl]methyl acetate CAS Name: acetic acid [2-bromo-3-cyano-4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [2-bromo-3-cyano-4-(2-cyanophenyl)phenyl]methyl acetate Traditional Name: acetic acid [2-bromo-3-cyano-4-(2-cyanophenyl)benzyl] ester Formula: C17H11BrN2O2 MolecularWeight: 355.18544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C(=C(C=C1)C2=CC=CC=C2C#N)C#N)Br

Isomeric SMILES

CC(=O)OCC1=C(C(=C(C=C1)C2=CC=CC=C2C#N)C#N)Br

InChI

InChI=1S/C17H11BrN2O2/c1-11(21)22-10-13-6-7-15(16(9-20)17(13)18)14-5-3-2-4-12(14)8-19/h2-7H,10H2,1H3