2-[4-bromanyl-2-[(E)-2-cyano-2-(3-methylphenyl)ethenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-bromanyl-2-[(E)-2-cyano-2-(3-methylphenyl)ethenyl]phenoxy]ethanoic acid Openeye Name: 2-[4-bromo-2-[(E)-2-cyano-2-(m-tolyl)vinyl]phenoxy]acetic acid CAS Name: 2-[4-bromo-2-[(E)-2-cyano-2-(3-methylphenyl)ethenyl]phenoxy]acetic acid IUPAC Name: 2-[4-bromo-2-[(E)-2-cyano-2-(3-methylphenyl)ethenyl]phenoxy]acetic acid Traditional Name: 2-[4-bromo-2-[(E)-2-cyano-2-(m-tolyl)vinyl]phenoxy]acetic acid Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=CC2=C(C=CC(=C2)Br)OCC(=O)O)C#N

Isomeric SMILES

CC1=CC=CC(=C1)/C(=C\C2=C(C=CC(=C2)Br)OCC(=O)O)/C#N

InChI

InChI=1S/C18H14BrNO3/c1-12-3-2-4-13(7-12)15(10-20)8-14-9-16(19)5-6-17(14)23-11-18(21)22/h2-9H,11H2,1H3,(H,21,22)/b15-8-