diethyl 2-acetamido-2-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxy-phenyl)methyl]propanedioate CAS Name: 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(2-bromo-3,4-dimethoxyphenyl)methyl]propanedioate Traditional Name: 2-acetamido-2-(2-bromo-3,4-dimethoxy-benzyl)malonic acid diethyl ester Formula: C18H24BrNO7 MolecularWeight: 446.28966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C(=C(C=C1)OC)OC)Br)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(C(=C(C=C1)OC)OC)Br)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H24BrNO7/c1-6-26-16(22)18(20-11(3)21,17(23)27-7-2)10-12-8-9-13(24-4)15(25-5)14(12)19/h8-9H,6-7,10H2,1-5H3,(H,20,21)