[3-methoxy-4-[methyl(3-phenylpropanoyl)amino]phenyl]boronic acid

Systemtic Name: [3-methoxy-4-[methyl(3-phenylpropanoyl)amino]phenyl]boronic acid Openeye Name: [3-methoxy-4-[methyl(3-phenylpropanoyl)amino]phenyl]boronic acid CAS Name: [3-methoxy-4-[methyl-(1-oxo-3-phenylpropyl)amino]phenyl]boronic acid IUPAC Name: [3-methoxy-4-[methyl(3-phenylpropanoyl)amino]phenyl]boronic acid Traditional Name: [4-[hydrocinnamoyl(methyl)amino]-3-methoxy-phenyl]boronic acid Formula: C17H20BNO4 MolecularWeight: 313.156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)N(C)C(=O)CCC2=CC=CC=C2)OC)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)N(C)C(=O)CCC2=CC=CC=C2)OC)(O)O

InChI

InChI=1S/C17H20BNO4/c1-19(17(20)11-8-13-6-4-3-5-7-13)15-10-9-14(18(21)22)12-16(15)23-2/h3-7,9-10,12,21-22H,8,11H2,1-2H3