3-phenylpropyl 3-bromanyl-4-ethoxy-benzoate

Systemtic Name: 3-phenylpropyl 3-bromanyl-4-ethoxy-benzoate Openeye Name: 3-phenylpropyl 3-bromo-4-ethoxy-benzoate CAS Name: 3-bromo-4-ethoxybenzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-bromo-4-ethoxybenzoate Traditional Name: 3-bromo-4-ethoxy-benzoic acid 3-phenylpropyl ester Formula: C18H19BrO3 MolecularWeight: 363.24566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCCCC2=CC=CC=C2)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCCCC2=CC=CC=C2)Br

InChI

InChI=1S/C18H19BrO3/c1-2-21-17-11-10-15(13-16(17)19)18(20)22-12-6-9-14-7-4-3-5-8-14/h3-5,7-8,10-11,13H,2,6,9,12H2,1H3