(4-bromanyl-2,6-dimethyl-phenyl) 4-pentoxybenzoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 4-pentoxybenzoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C20H23BrO3 MolecularWeight: 391.29882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C20H23BrO3/c1-4-5-6-11-23-18-9-7-16(8-10-18)20(22)24-19-14(2)12-17(21)13-15(19)3/h7-10,12-13H,4-6,11H2,1-3H3