[4-[(2S)-2-[bis(phenylmethyl)amino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenyl]boronic acid

Systemtic Name: [4-[(2S)-2-[bis(phenylmethyl)amino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenyl]boronic acid Openeye Name: [4-[(2S)-3-benzyloxy-2-(dibenzylamino)-3-oxo-propyl]phenyl]boronic acid CAS Name: [4-[(2S)-2-[bis(phenylmethyl)amino]-3-oxo-3-phenylmethoxypropyl]phenyl]boronic acid IUPAC Name: [4-[(2S)-2-(dibenzylamino)-3-oxo-3-phenylmethoxypropyl]phenyl]boronic acid Traditional Name: [4-[(2S)-3-benzoxy-2-(dibenzylamino)-3-keto-propyl]phenyl]boronic acid Formula: C30H30BNO4 MolecularWeight: 479.3745

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)(O)O

InChI

InChI=1S/C30H30BNO4/c33-30(36-23-27-14-8-3-9-15-27)29(20-24-16-18-28(19-17-24)31(34)35)32(21-25-10-4-1-5-11-25)22-26-12-6-2-7-13-26/h1-19,29,34-35H,20-23H2/t29-/m0/s1