2-methyl-4-(propylsulfonylamino)-2-[3-(pyridin-3-ylmethyl)phenyl]butanoic acid

Systemtic Name: 2-methyl-4-(propylsulfonylamino)-2-[3-(pyridin-3-ylmethyl)phenyl]butanoic acid Openeye Name: 2-methyl-4-(propylsulfonylamino)-2-[3-(3-pyridylmethyl)phenyl]butanoic acid CAS Name: 2-methyl-4-(propylsulfonylamino)-2-[3-(3-pyridinylmethyl)phenyl]butanoic acid IUPAC Name: 2-methyl-4-(propylsulfonylamino)-2-[3-(pyridin-3-ylmethyl)phenyl]butanoic acid Traditional Name: 2-methyl-4-(propylsulfonylamino)-2-[3-(3-pyridylmethyl)phenyl]butyric acid Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NCCC(C)(C1=CC=CC(=C1)CC2=CN=CC=C2)C(=O)O

Isomeric SMILES

CCCS(=O)(=O)NCCC(C)(C1=CC=CC(=C1)CC2=CN=CC=C2)C(=O)O

InChI

InChI=1S/C20H26N2O4S/c1-3-12-27(25,26)22-11-9-20(2,19(23)24)18-8-4-6-16(14-18)13-17-7-5-10-21-15-17/h4-8,10,14-15,22H,3,9,11-13H2,1-2H3,(H,23,24)