diethyl 2-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]propanedioate

Systemtic Name: diethyl 2-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]propanedioate Openeye Name: diethyl 2-[[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]amino]propanedioate CAS Name: 2-[[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]amino]propanedioate Traditional Name: 2-[[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]amino]malonic acid diethyl ester Formula: C17H20BrNO5 MolecularWeight: 398.2484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)/C=C/C1=C(C=C(C=C1)C)Br

InChI

InChI=1S/C17H20BrNO5/c1-4-23-16(21)15(17(22)24-5-2)19-14(20)9-8-12-7-6-11(3)10-13(12)18/h6-10,15H,4-5H2,1-3H3,(H,19,20)/b9-8+