[3-[(2-ethyl-5-methoxy-2,4,4-trimethyl-5-oxidanylidene-pentanoyl)amino]phenyl]boronic acid

Systemtic Name: [3-[(2-ethyl-5-methoxy-2,4,4-trimethyl-5-oxidanylidene-pentanoyl)amino]phenyl]boronic acid Openeye Name: [3-[(2-ethyl-5-methoxy-2,4,4-trimethyl-5-oxo-pentanoyl)amino]phenyl]boronic acid CAS Name: [3-[(2-ethyl-5-methoxy-2,4,4-trimethyl-1,5-dioxopentyl)amino]phenyl]boronic acid IUPAC Name: [3-[(2-ethyl-5-methoxy-2,4,4-trimethyl-5-oxopentanoyl)amino]phenyl]boronic acid Traditional Name: [3-[(2-ethyl-5-keto-5-methoxy-2,4,4-trimethyl-pentanoyl)amino]phenyl]boronic acid Formula: C17H26BNO5 MolecularWeight: 335.20304

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)NC(=O)C(C)(CC)CC(C)(C)C(=O)OC)(O)O

Isomeric SMILES

B(C1=CC(=CC=C1)NC(=O)C(C)(CC)CC(C)(C)C(=O)OC)(O)O

InChI

InChI=1S/C17H26BNO5/c1-6-17(4,11-16(2,3)15(21)24-5)14(20)19-13-9-7-8-12(10-13)18(22)23/h7-10,22-23H,6,11H2,1-5H3,(H,19,20)