(2-bromanyl-4-butan-2-yl-phenyl) 2-propoxybenzoate

Systemtic Name: (2-bromanyl-4-butan-2-yl-phenyl) 2-propoxybenzoate Openeye Name: (2-bromo-4-sec-butyl-phenyl) 2-propoxybenzoate CAS Name: 2-propoxybenzoic acid (2-bromo-4-butan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-butan-2-ylphenyl) 2-propoxybenzoate Traditional Name: 2-propoxybenzoic acid (2-bromo-4-sec-butyl-phenyl) ester Formula: C20H23BrO3 MolecularWeight: 391.29882

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(C)CC)Br

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C(C)CC)Br

InChI

InChI=1S/C20H23BrO3/c1-4-12-23-18-9-7-6-8-16(18)20(22)24-19-11-10-15(13-17(19)21)14(3)5-2/h6-11,13-14H,4-5,12H2,1-3H3