(2S)-3-[4-(6-azanylhexoxy)phenyl]-2-(butylsulfonylamino)propanoic acid

Systemtic Name: (2S)-3-[4-(6-azanylhexoxy)phenyl]-2-(butylsulfonylamino)propanoic acid Openeye Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butylsulfonylamino)propanoic acid CAS Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butylsulfonylamino)propanoic acid IUPAC Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butylsulfonylamino)propanoic acid Traditional Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butylsulfonylamino)propionic acid Formula: C19H32N2O5S MolecularWeight: 400.53278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](CC1=CC=C(C=C1)OCCCCCCN)C(=O)O

InChI

InChI=1S/C19H32N2O5S/c1-2-3-14-27(24,25)21-18(19(22)23)15-16-8-10-17(11-9-16)26-13-7-5-4-6-12-20/h8-11,18,21H,2-7,12-15,20H2,1H3,(H,22,23)/t18-/m0/s1