bis(prop-2-enyl) 2-[3-(4-aminocarbonylphenyl)-1-(4-bromophenyl)-3-oxidanylidene-propyl]propanedioate

Systemtic Name: bis(prop-2-enyl) 2-[3-(4-aminocarbonylphenyl)-1-(4-bromophenyl)-3-oxidanylidene-propyl]propanedioate Openeye Name: diallyl 2-[1-(4-bromophenyl)-3-(4-carbamoylphenyl)-3-oxo-propyl]propanedioate CAS Name: 2-[1-(4-bromophenyl)-3-(4-carbamoylphenyl)-3-oxopropyl]propanedioic acid bis(prop-2-enyl) ester IUPAC Name: bis(prop-2-enyl) 2-[1-(4-bromophenyl)-3-(4-carbamoylphenyl)-3-oxopropyl]propanedioate Traditional Name: 2-[1-(4-bromophenyl)-3-(4-carbamoylphenyl)-3-keto-propyl]malonic acid diallyl ester Formula: C25H24BrNO6 MolecularWeight: 514.36516

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(C(CC(=O)C1=CC=C(C=C1)C(=O)N)C2=CC=C(C=C2)Br)C(=O)OCC=C

Isomeric SMILES

C=CCOC(=O)C(C(CC(=O)C1=CC=C(C=C1)C(=O)N)C2=CC=C(C=C2)Br)C(=O)OCC=C

InChI

InChI=1S/C25H24BrNO6/c1-3-13-32-24(30)22(25(31)33-14-4-2)20(16-9-11-19(26)12-10-16)15-21(28)17-5-7-18(8-6-17)23(27)29/h3-12,20,22H,1-2,13-15H2,(H2,27,29)