2-methylpropyl 4-bromanyl-2-pentoxy-benzoate

Systemtic Name: 2-methylpropyl 4-bromanyl-2-pentoxy-benzoate Openeye Name: isobutyl 4-bromo-2-pentoxy-benzoate CAS Name: 4-bromo-2-pentoxybenzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-bromo-2-pentoxybenzoate Traditional Name: 2-amoxy-4-bromo-benzoic acid isobutyl ester Formula: C16H23BrO3 MolecularWeight: 343.25602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)Br)C(=O)OCC(C)C

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)Br)C(=O)OCC(C)C

InChI

InChI=1S/C16H23BrO3/c1-4-5-6-9-19-15-10-13(17)7-8-14(15)16(18)20-11-12(2)3/h7-8,10,12H,4-6,9,11H2,1-3H3