[(E)-5-[4-(2-acetamidoethyl)pyridin-1-ium-1-yl]pent-1-enyl]boronic acid

Systemtic Name: [(E)-5-[4-(2-acetamidoethyl)pyridin-1-ium-1-yl]pent-1-enyl]boronic acid Openeye Name: [(E)-5-[4-(2-acetamidoethyl)pyridin-1-ium-1-yl]pent-1-enyl]boronic acid CAS Name: [(E)-5-[4-(2-acetamidoethyl)-1-pyridin-1-iumyl]pent-1-enyl]boronic acid IUPAC Name: [(E)-5-[4-(2-acetamidoethyl)pyridin-1-ium-1-yl]pent-1-enyl]boronic acid Traditional Name: [(E)-5-[4-(2-acetamidoethyl)pyridin-1-ium-1-yl]pent-1-enyl]boronic acid Formula: C14H22BN2O3+ MolecularWeight: 277.14708

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Descriptors Computed from Structure

Canonical SMILES:

B(C=CCCC[N+]1=CC=C(C=C1)CCNC(=O)C)(O)O

Isomeric SMILES

B(/C=C/CCC[N+]1=CC=C(C=C1)CCNC(=O)C)(O)O

InChI

InChI=1S/C14H21BN2O3/c1-13(18)16-9-5-14-6-11-17(12-7-14)10-4-2-3-8-15(19)20/h3,6-8,11-12,19-20H,2,4-5,9-10H2,1H3/p+1/b8-3+