[4-(4-cyanophenyl)phenyl] 2-bromanyl-5-methoxy-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-bromanyl-5-methoxy-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C21H14BrNO3 MolecularWeight: 408.24476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H14BrNO3/c1-25-18-10-11-20(22)19(12-18)21(24)26-17-8-6-16(7-9-17)15-4-2-14(13-23)3-5-15/h2-12H,1H3