ethyl 4-[2-(bromomethyl)-7-ethoxy-7-oxidanylidene-heptyl]benzoate

Systemtic Name: ethyl 4-[2-(bromomethyl)-7-ethoxy-7-oxidanylidene-heptyl]benzoate Openeye Name: ethyl 4-[2-(bromomethyl)-7-ethoxy-7-oxo-heptyl]benzoate CAS Name: 4-[2-(bromomethyl)-7-ethoxy-7-oxoheptyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(bromomethyl)-7-ethoxy-7-oxoheptyl]benzoate Traditional Name: 4-[2-(bromomethyl)-7-ethoxy-7-keto-heptyl]benzoic acid ethyl ester Formula: C19H27BrO4 MolecularWeight: 399.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(CC1=CC=C(C=C1)C(=O)OCC)CBr

Isomeric SMILES

CCOC(=O)CCCCC(CC1=CC=C(C=C1)C(=O)OCC)CBr

InChI

InChI=1S/C19H27BrO4/c1-3-23-18(21)8-6-5-7-16(14-20)13-15-9-11-17(12-10-15)19(22)24-4-2/h9-12,16H,3-8,13-14H2,1-2H3