1-[[3-(2,2-diphenylethylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid

Systemtic Name: 1-[[3-(2,2-diphenylethylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid Openeye Name: 1-[[3-(2,2-diphenylethylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid CAS Name: 1-[[3-[(2,2-diphenylethylamino)-oxomethyl]-3-formamidocyclopentyl]amino]butylboronic acid IUPAC Name: 1-[[3-(2,2-diphenylethylcarbamoyl)-3-formamidocyclopentyl]amino]butylboronic acid Traditional Name: 1-[[3-(2,2-diphenylethylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid Formula: C25H34BN3O4 MolecularWeight: 451.36616

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CCC)NC1CCC(C1)(C(=O)NCC(C2=CC=CC=C2)C3=CC=CC=C3)NC=O)(O)O

Isomeric SMILES

B(C(CCC)NC1CCC(C1)(C(=O)NCC(C2=CC=CC=C2)C3=CC=CC=C3)NC=O)(O)O

InChI

InChI=1S/C25H34BN3O4/c1-2-9-23(26(32)33)29-21-14-15-25(16-21,28-18-30)24(31)27-17-22(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,18,21-23,29,32-33H,2,9,14-17H2,1H3,(H,27,31)(H,28,30)