2-(butylsulfonylamino)-3-[[3-oxidanylidene-2-(2-piperidin-4-ylethyl)-1,2-dihydroinden-5-yl]carbonylamino]propanoic acid

Systemtic Name: 2-(butylsulfonylamino)-3-[[3-oxidanylidene-2-(2-piperidin-4-ylethyl)-1,2-dihydroinden-5-yl]carbonylamino]propanoic acid Openeye Name: 2-(butylsulfonylamino)-3-[[3-oxo-2-[2-(4-piperidyl)ethyl]indane-5-carbonyl]amino]propanoic acid CAS Name: 2-(butylsulfonylamino)-3-[[oxo-[3-oxo-2-[2-(4-piperidinyl)ethyl]-1,2-dihydroinden-5-yl]methyl]amino]propanoic acid IUPAC Name: 2-(butylsulfonylamino)-3-[[3-oxo-2-(2-piperidin-4-ylethyl)-1,2-dihydroindene-5-carbonyl]amino]propanoic acid Traditional Name: 2-(butylsulfonylamino)-3-[[3-keto-2-[2-(4-piperidyl)ethyl]indane-5-carbonyl]amino]propionic acid Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CNC(=O)C1=CC2=C(CC(C2=O)CCC3CCNCC3)C=C1)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)NC(CNC(=O)C1=CC2=C(CC(C2=O)CCC3CCNCC3)C=C1)C(=O)O

InChI

InChI=1S/C24H35N3O6S/c1-2-3-12-34(32,33)27-21(24(30)31)15-26-23(29)19-7-6-17-13-18(22(28)20(17)14-19)5-4-16-8-10-25-11-9-16/h6-7,14,16,18,21,25,27H,2-5,8-13,15H2,1H3,(H,26,29)(H,30,31)