diethyl 2-acetamido-2-[[2-fluoranyl-5-(phenylmethyl)phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[2-fluoranyl-5-(phenylmethyl)phenyl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(5-benzyl-2-fluoro-phenyl)methyl]propanedioate CAS Name: 2-acetamido-2-[[2-fluoro-5-(phenylmethyl)phenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(5-benzyl-2-fluorophenyl)methyl]propanedioate Traditional Name: 2-acetamido-2-(5-benzyl-2-fluoro-benzyl)malonic acid diethyl ester Formula: C23H26FNO5 MolecularWeight: 415.454643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=CC(=C1)CC2=CC=CC=C2)F)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(C=CC(=C1)CC2=CC=CC=C2)F)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C23H26FNO5/c1-4-29-21(27)23(25-16(3)26,22(28)30-5-2)15-19-14-18(11-12-20(19)24)13-17-9-7-6-8-10-17/h6-12,14H,4-5,13,15H2,1-3H3,(H,25,26)