8-(diethylamino)-2-oxidanyl-2-phenyl-oct-6-yn-3-one; ethanedioic acid

Systemtic Name: 8-(diethylamino)-2-oxidanyl-2-phenyl-oct-6-yn-3-one; ethanedioic acid Openeye Name: 8-(diethylamino)-2-hydroxy-2-phenyl-oct-6-yn-3-one; oxalic acid CAS Name: 8-(diethylamino)-2-hydroxy-2-phenyl-6-octyn-3-one; oxalic acid IUPAC Name: 8-(diethylamino)-2-hydroxy-2-phenyloct-6-yn-3-one; oxalic acid Traditional Name: 8-(diethylamino)-2-hydroxy-2-phenyl-oct-6-yn-3-one; oxalic acid Formula: C20H27NO6 MolecularWeight: 377.43148

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCCC(=O)C(C)(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC#CCCC(=O)C(C)(C1=CC=CC=C1)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H25NO2.C2H2O4/c1-4-19(5-2)15-11-7-10-14-17(20)18(3,21)16-12-8-6-9-13-16;3-1(4)2(5)6/h6,8-9,12-13,21H,4-5,10,14-15H2,1-3H3;(H,3,4)(H,5,6)