[7-oxidanylidene-7-[(3-phenoxyphenyl)amino]heptyl]boronic acid

Systemtic Name: [7-oxidanylidene-7-[(3-phenoxyphenyl)amino]heptyl]boronic acid Openeye Name: [7-oxo-7-(3-phenoxyanilino)heptyl]boronic acid CAS Name: [7-oxo-7-(3-phenoxyanilino)heptyl]boronic acid IUPAC Name: [7-oxo-7-(3-phenoxyanilino)heptyl]boronic acid Traditional Name: [7-keto-7-(3-phenoxyanilino)heptyl]boronic acid Formula: C19H24BNO4 MolecularWeight: 341.20916

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Descriptors Computed from Structure

Canonical SMILES:

B(CCCCCCC(=O)NC1=CC(=CC=C1)OC2=CC=CC=C2)(O)O

Isomeric SMILES

B(CCCCCCC(=O)NC1=CC(=CC=C1)OC2=CC=CC=C2)(O)O

InChI

InChI=1S/C19H24BNO4/c22-19(13-6-1-2-7-14-20(23)24)21-16-9-8-12-18(15-16)25-17-10-4-3-5-11-17/h3-5,8-12,15,23-24H,1-2,6-7,13-14H2,(H,21,22)