3-[5-bromanyl-2-[(2-cyanophenyl)methoxy]phenyl]prop-2-enoic acid

Systemtic Name: 3-[5-bromanyl-2-[(2-cyanophenyl)methoxy]phenyl]prop-2-enoic acid Openeye Name: 3-[5-bromo-2-[(2-cyanophenyl)methoxy]phenyl]prop-2-enoic acid CAS Name: 3-[5-bromo-2-[(2-cyanophenyl)methoxy]phenyl]-2-propenoic acid IUPAC Name: 3-[5-bromo-2-[(2-cyanophenyl)methoxy]phenyl]prop-2-enoic acid Traditional Name: 3-[5-bromo-2-(2-cyanobenzyl)oxy-phenyl]acrylic acid Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C=CC(=O)O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2)Br)C=CC(=O)O)C#N

InChI

InChI=1S/C17H12BrNO3/c18-15-6-7-16(12(9-15)5-8-17(20)21)22-11-14-4-2-1-3-13(14)10-19/h1-9H,11H2,(H,20,21)