3-phenylpropyl 3-bromanyl-4-propoxy-benzoate

Systemtic Name: 3-phenylpropyl 3-bromanyl-4-propoxy-benzoate Openeye Name: 3-phenylpropyl 3-bromo-4-propoxy-benzoate CAS Name: 3-bromo-4-propoxybenzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-bromo-4-propoxybenzoate Traditional Name: 3-bromo-4-propoxy-benzoic acid 3-phenylpropyl ester Formula: C19H21BrO3 MolecularWeight: 377.27224

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OCCCC2=CC=CC=C2)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OCCCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H21BrO3/c1-2-12-22-18-11-10-16(14-17(18)20)19(21)23-13-6-9-15-7-4-3-5-8-15/h3-5,7-8,10-11,14H,2,6,9,12-13H2,1H3