N-[(E)-3-chloranylprop-2-enyl]-N-(7-cyano-1-iodanyl-4-methyl-naphthalen-2-yl)-methyl-boronamidic acid

Systemtic Name: N-[(E)-3-chloranylprop-2-enyl]-N-(7-cyano-1-iodanyl-4-methyl-naphthalen-2-yl)-methyl-boronamidic acid Openeye Name: N-[(E)-3-chloroallyl]-N-(7-cyano-1-iodo-4-methyl-2-naphthyl)-methyl-boronamidic acid CAS Name: N-[(E)-3-chloroprop-2-enyl]-N-(7-cyano-1-iodo-4-methyl-2-naphthalenyl)-methylboronamidic acid IUPAC Name: N-[(E)-3-chloroprop-2-enyl]-N-(7-cyano-1-iodo-4-methylnaphthalen-2-yl)-methylboronamidic acid Traditional Name: N-[(E)-3-chloroallyl]-N-(7-cyano-1-iodo-4-methyl-2-naphthyl)-methyl-boronamidic acid Formula: C16H15BClIN2O MolecularWeight: 424.47157

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N(CC=CCl)C1=C(C2=C(C=CC(=C2)C#N)C(=C1)C)I)O

Isomeric SMILES

B(C)(N(C/C=C/Cl)C1=C(C2=C(C=CC(=C2)C#N)C(=C1)C)I)O

InChI

InChI=1S/C16H15BClIN2O/c1-11-8-15(21(17(2)22)7-3-6-18)16(19)14-9-12(10-20)4-5-13(11)14/h3-6,8-9,22H,7H2,1-2H3/b6-3+