ethyl (E)-5-(4-bromophenyl)-2,2-diethyl-3-oxidanylidene-pent-4-enoate

Systemtic Name: ethyl (E)-5-(4-bromophenyl)-2,2-diethyl-3-oxidanylidene-pent-4-enoate Openeye Name: ethyl (E)-5-(4-bromophenyl)-2,2-diethyl-3-oxo-pent-4-enoate CAS Name: (E)-5-(4-bromophenyl)-2,2-diethyl-3-oxo-4-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-(4-bromophenyl)-2,2-diethyl-3-oxopent-4-enoate Traditional Name: (E)-5-(4-bromophenyl)-2,2-diethyl-3-keto-pent-4-enoic acid ethyl ester Formula: C17H21BrO3 MolecularWeight: 353.25084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)C=CC1=CC=C(C=C1)Br)C(=O)OCC

Isomeric SMILES

CCC(CC)(C(=O)/C=C/C1=CC=C(C=C1)Br)C(=O)OCC

InChI

InChI=1S/C17H21BrO3/c1-4-17(5-2,16(20)21-6-3)15(19)12-9-13-7-10-14(18)11-8-13/h7-12H,4-6H2,1-3H3/b12-9+