ethyl 3-azanyl-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoate

Systemtic Name: ethyl 3-azanyl-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoate Openeye Name: ethyl 3-amino-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoate CAS Name: 3-amino-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoate Traditional Name: 3-amino-2-[(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)methylamino]benzoic acid ethyl ester Formula: C15H23BN2O4 MolecularWeight: 306.16512

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)CNC2=C(C=CC=C2N)C(=O)OCC

Isomeric SMILES

B1(OCC(CO1)(C)C)CNC2=C(C=CC=C2N)C(=O)OCC

InChI

InChI=1S/C15H23BN2O4/c1-4-20-14(19)11-6-5-7-12(17)13(11)18-10-16-21-8-15(2,3)9-22-16/h5-7,18H,4,8-10,17H2,1-3H3