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

Systemtic Name: ethyl 5-(3-bromophenyl)-2,2-diethyl-3-oxidanylidene-pent-4-enoate Openeye Name: ethyl 5-(3-bromophenyl)-2,2-diethyl-3-oxo-pent-4-enoate CAS Name: 5-(3-bromophenyl)-2,2-diethyl-3-oxo-4-pentenoic acid ethyl ester IUPAC Name: ethyl 5-(3-bromophenyl)-2,2-diethyl-3-oxopent-4-enoate Traditional Name: 5-(3-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(=CC=C1)Br)C(=O)OCC

Isomeric SMILES

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

InChI

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