2-[[5-(4-phenylbutylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[5-(4-phenylbutylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-(4-phenylbutylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[5-[oxo-(4-phenylbutylsulfonylamino)methyl]-2-pyridinyl]methyl]amino]acetic acid IUPAC Name: 2-[[5-(4-phenylbutylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetic acid Traditional Name: 2-[[5-(4-phenylbutylsulfonylcarbamoyl)picolinoyl]amino]acetic acid Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCS(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCS(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C19H21N3O6S/c23-17(24)13-21-19(26)16-10-9-15(12-20-16)18(25)22-29(27,28)11-5-4-8-14-6-2-1-3-7-14/h1-3,6-7,9-10,12H,4-5,8,11,13H2,(H,21,26)(H,22,25)(H,23,24)