1-[[3-formamido-3-[(phenylmethyl)carbamoyl]cyclopentyl]amino]butylboronic acid

Systemtic Name: 1-[[3-formamido-3-[(phenylmethyl)carbamoyl]cyclopentyl]amino]butylboronic acid Openeye Name: 1-[[3-(benzylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid CAS Name: 1-[[3-formamido-3-[oxo-[(phenylmethyl)amino]methyl]cyclopentyl]amino]butylboronic acid IUPAC Name: 1-[[3-(benzylcarbamoyl)-3-formamidocyclopentyl]amino]butylboronic acid Traditional Name: 1-[[3-(benzylcarbamoyl)-3-formamido-cyclopentyl]amino]butylboronic acid Formula: C18H28BN3O4 MolecularWeight: 361.24362

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Descriptors Computed from Structure

Canonical SMILES:

B(C(CCC)NC1CCC(C1)(C(=O)NCC2=CC=CC=C2)NC=O)(O)O

Isomeric SMILES

B(C(CCC)NC1CCC(C1)(C(=O)NCC2=CC=CC=C2)NC=O)(O)O

InChI

InChI=1S/C18H28BN3O4/c1-2-6-16(19(25)26)22-15-9-10-18(11-15,21-13-23)17(24)20-12-14-7-4-3-5-8-14/h3-5,7-8,13,15-16,22,25-26H,2,6,9-12H2,1H3,(H,20,24)(H,21,23)