(3S)-3-(butylsulfonylamino)-4-[4-(3-piperidin-4-ylpropoxy)phenyl]butanoic acid

Systemtic Name: (3S)-3-(butylsulfonylamino)-4-[4-(3-piperidin-4-ylpropoxy)phenyl]butanoic acid Openeye Name: (3S)-3-(butylsulfonylamino)-4-[4-[3-(4-piperidyl)propoxy]phenyl]butanoic acid CAS Name: (3S)-3-(butylsulfonylamino)-4-[4-[3-(4-piperidinyl)propoxy]phenyl]butanoic acid IUPAC Name: (3S)-3-(butylsulfonylamino)-4-[4-(3-piperidin-4-ylpropoxy)phenyl]butanoic acid Traditional Name: (3S)-3-(butylsulfonylamino)-4-[4-[3-(4-piperidyl)propoxy]phenyl]butyric acid Formula: C22H36N2O5S MolecularWeight: 440.59664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=CC=C(C=C1)OCCCC2CCNCC2)CC(=O)O

Isomeric SMILES

CCCCS(=O)(=O)N[C@@H](CC1=CC=C(C=C1)OCCCC2CCNCC2)CC(=O)O

InChI

InChI=1S/C22H36N2O5S/c1-2-3-15-30(27,28)24-20(17-22(25)26)16-19-6-8-21(9-7-19)29-14-4-5-18-10-12-23-13-11-18/h6-9,18,20,23-24H,2-5,10-17H2,1H3,(H,25,26)/t20-/m0/s1