methyl 2-azanyl-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propanoate

Systemtic Name: methyl 2-azanyl-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propanoate Openeye Name: methyl 2-amino-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propanoate CAS Name: 2-amino-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propanoate Traditional Name: 2-amino-3-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]propionic acid methyl ester Formula: C15H22BNO4 MolecularWeight: 291.15048

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)C2=CC=C(C=C2)CC(C(=O)OC)N

Isomeric SMILES

B1(OCC(CO1)(C)C)C2=CC=C(C=C2)CC(C(=O)OC)N

InChI

InChI=1S/C15H22BNO4/c1-15(2)9-20-16(21-10-15)12-6-4-11(5-7-12)8-13(17)14(18)19-3/h4-7,13H,8-10,17H2,1-3H3