4,4-dimethyl-1-[methyl(prop-2-ynyl)amino]-2-oxidanyl-1-phenyl-pentan-3-one; ethanedioic acid

Systemtic Name: 4,4-dimethyl-1-[methyl(prop-2-ynyl)amino]-2-oxidanyl-1-phenyl-pentan-3-one; ethanedioic acid Openeye Name: 2-hydroxy-4,4-dimethyl-1-[methyl(prop-2-ynyl)amino]-1-phenyl-pentan-3-one; oxalic acid CAS Name: 2-hydroxy-4,4-dimethyl-1-[methyl(prop-2-ynyl)amino]-1-phenyl-3-pentanone; oxalic acid IUPAC Name: 2-hydroxy-4,4-dimethyl-1-[methyl(prop-2-ynyl)amino]-1-phenylpentan-3-one; oxalic acid Traditional Name: 2-hydroxy-4,4-dimethyl-1-[methyl(propargyl)amino]-1-phenyl-pentan-3-one; oxalic acid Formula: C19H25NO6 MolecularWeight: 363.4049

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(C1=CC=CC=C1)N(C)CC#C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C(=O)C(C(C1=CC=CC=C1)N(C)CC#C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H23NO2.C2H2O4/c1-6-12-18(5)14(13-10-8-7-9-11-13)15(19)16(20)17(2,3)4;3-1(4)2(5)6/h1,7-11,14-15,19H,12H2,2-5H3;(H,3,4)(H,5,6)