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3-[4-(4-azanylbutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid

3-[4-(4-azanylbutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid

Systemtic Name:3-[4-(4-azanylbutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid
Openeye Name:3-[4-(4-aminobutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid
CAS Name:3-[4-(4-aminobutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid
IUPAC Name:3-[4-(4-aminobutoxy)phenyl]-2-(butylsulfonylamino)propanoic acid
Traditional Name:3-[4-(4-aminobutoxy)phenyl]-2-(butylsulfonylamino)propionic acid
Formula: C17H28N2O5S
MolecularWeight: 372.47962
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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=CC=C(C=C1)OCCCCN)C(=O)O


Isomeric SMILES

CCCCS(=O)(=O)NC(CC1=CC=C(C=C1)OCCCCN)C(=O)O


InChI

InChI=1S/C17H28N2O5S/c1-2-3-12-25(22,23)19-16(17(20)21)13-14-6-8-15(9-7-14)24-11-5-4-10-18/h6-9,16,19H,2-5,10-13,18H2,1H3,(H,20,21)


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