4-[4-piperidin-1-ylsulfonyl-2-(pyrazin-2-ylcarbonylamino)phenoxy]benzoic acid

Systemtic Name: 4-[4-piperidin-1-ylsulfonyl-2-(pyrazin-2-ylcarbonylamino)phenoxy]benzoic acid Openeye Name: 4-[4-(1-piperidylsulfonyl)-2-(pyrazine-2-carbonylamino)phenoxy]benzoic acid CAS Name: 4-[2-[[oxo(2-pyrazinyl)methyl]amino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid IUPAC Name: 4-[4-piperidin-1-ylsulfonyl-2-(pyrazine-2-carbonylamino)phenoxy]benzoic acid Traditional Name: 4-[4-piperidinosulfonyl-2-(pyrazinoylamino)phenoxy]benzoic acid Formula: C23H22N4O6S MolecularWeight: 482.50898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4=NC=CN=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C23H22N4O6S/c28-22(20-15-24-10-11-25-20)26-19-14-18(34(31,32)27-12-2-1-3-13-27)8-9-21(19)33-17-6-4-16(5-7-17)23(29)30/h4-11,14-15H,1-3,12-13H2,(H,26,28)(H,29,30)