2-[[4-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[[4-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid CAS Name: 2-[[4-[[4-morpholinyl(oxo)methyl]amino]phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid IUPAC Name: 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenylpent-4-ynoic acid Traditional Name: 2-[[4-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1COCCN1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H23N3O6S/c26-21(27)20(8-4-7-17-5-2-1-3-6-17)24-32(29,30)19-11-9-18(10-12-19)23-22(28)25-13-15-31-16-14-25/h1-3,5-6,9-12,20,24H,8,13-16H2,(H,23,28)(H,26,27)