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butylboronic acid; 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]ethanamide

butylboronic acid; 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]ethanamide

Systemtic Name:butylboronic acid; 2-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]ethanamide
Openeye Name:butylboronic acid; 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acetamide
CAS Name:butylboronic acid; 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
IUPAC Name:butylboronic acid; 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
Traditional Name:butylboronic acid; 2-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acetamide
Formula: C18H33BN2O5
MolecularWeight: 368.27602
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Descriptors Computed from Structure

Canonical SMILES:

B(CCCC)(O)O.CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O


Isomeric SMILES

B(CCCC)(O)O.CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O


InChI

InChI=1S/C14H22N2O3.C4H11BO2/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18;1-2-3-4-5(6)7/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18);6-7H,2-4H2,1H3


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