[4-[(E)-3-(4-iodophenyl)prop-2-enoyl]phenoxy]methylboronic acid

Systemtic Name: [4-[(E)-3-(4-iodophenyl)prop-2-enoyl]phenoxy]methylboronic acid Openeye Name: [4-[(E)-3-(4-iodophenyl)prop-2-enoyl]phenoxy]methylboronic acid CAS Name: [4-[(E)-3-(4-iodophenyl)-1-oxoprop-2-enyl]phenoxy]methylboronic acid IUPAC Name: [4-[(E)-3-(4-iodophenyl)prop-2-enoyl]phenoxy]methylboronic acid Traditional Name: [4-[(E)-3-(4-iodophenyl)acryloyl]phenoxy]methylboronic acid Formula: C16H14BIO4 MolecularWeight: 407.99543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(COC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)I)(O)O

Isomeric SMILES

B(COC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)I)(O)O

InChI

InChI=1S/C16H14BIO4/c18-14-6-1-12(2-7-14)3-10-16(19)13-4-8-15(9-5-13)22-11-17(20)21/h1-10,20-21H,11H2/b10-3+