diethyl 2-acetamido-2-[3-(5-methyl-2-oxidanyl-phenyl)-3-oxidanylidene-propyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[3-(5-methyl-2-oxidanyl-phenyl)-3-oxidanylidene-propyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[3-(2-hydroxy-5-methyl-phenyl)-3-oxo-propyl]propanedioate CAS Name: 2-acetamido-2-[3-(2-hydroxy-5-methylphenyl)-3-oxopropyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[3-(2-hydroxy-5-methylphenyl)-3-oxopropyl]propanedioate Traditional Name: 2-acetamido-2-[3-(2-hydroxy-5-methyl-phenyl)-3-keto-propyl]malonic acid diethyl ester Formula: C19H25NO7 MolecularWeight: 379.4043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C1=C(C=CC(=C1)C)O)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCC(=O)C1=C(C=CC(=C1)C)O)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C19H25NO7/c1-5-26-17(24)19(20-13(4)21,18(25)27-6-2)10-9-16(23)14-11-12(3)7-8-15(14)22/h7-8,11,22H,5-6,9-10H2,1-4H3,(H,20,21)