2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid

Systemtic Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid Openeye Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-pent-4-ynoic acid CAS Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenyl-4-pentynoic acid IUPAC Name: 2-[[4-(3-ethoxyphenyl)phenyl]sulfonylamino]-5-phenylpent-4-ynoic acid Traditional Name: 2-[(4-m-phenetylphenyl)sulfonylamino]-5-phenyl-pent-4-ynoic acid Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC#CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H23NO5S/c1-2-31-22-12-7-11-21(18-22)20-14-16-23(17-15-20)32(29,30)26-24(25(27)28)13-6-10-19-8-4-3-5-9-19/h3-5,7-9,11-12,14-18,24,26H,2,13H2,1H3,(H,27,28)