diethyl 2-[[3-acetamido-4-(bromomethyl)phenyl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[3-acetamido-4-(bromomethyl)phenyl]methylidene]propanedioate Openeye Name: diethyl 2-[[3-acetamido-4-(bromomethyl)phenyl]methylene]propanedioate CAS Name: 2-[[3-acetamido-4-(bromomethyl)phenyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-acetamido-4-(bromomethyl)phenyl]methylidene]propanedioate Traditional Name: 2-[3-acetamido-4-(bromomethyl)benzylidene]malonic acid diethyl ester Formula: C17H20BrNO5 MolecularWeight: 398.2484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)CBr)NC(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=CC(=C(C=C1)CBr)NC(=O)C)C(=O)OCC

InChI

InChI=1S/C17H20BrNO5/c1-4-23-16(21)14(17(22)24-5-2)8-12-6-7-13(10-18)15(9-12)19-11(3)20/h6-9H,4-5,10H2,1-3H3,(H,19,20)