ethyl 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: ethyl 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: ethyl 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-oxo-prop-1-enyl]benzoate CAS Name: 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-oxoprop-1-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-oxoprop-1-enyl]benzoate Traditional Name: 2-[2-(bromomethyl)phenyl]-6-[(E)-3-ethoxy-3-keto-prop-1-enyl]benzoic acid ethyl ester Formula: C21H21BrO4 MolecularWeight: 417.29304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=CC(=C1C(=O)OCC)C2=CC=CC=C2CBr

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=CC(=C1C(=O)OCC)C2=CC=CC=C2CBr

InChI

InChI=1S/C21H21BrO4/c1-3-25-19(23)13-12-15-9-7-11-18(20(15)21(24)26-4-2)17-10-6-5-8-16(17)14-22/h5-13H,3-4,14H2,1-2H3/b13-12+