(2-bromanyl-4-propan-2-yl-phenyl) 4-pentoxybenzoate

Systemtic Name: (2-bromanyl-4-propan-2-yl-phenyl) 4-pentoxybenzoate Openeye Name: (2-bromo-4-isopropyl-phenyl) 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid (2-bromo-4-propan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-propan-2-ylphenyl) 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid (2-bromo-4-isopropyl-phenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C21H25BrO3/c1-4-5-6-13-24-18-10-7-16(8-11-18)21(23)25-20-12-9-17(15(2)3)14-19(20)22/h7-12,14-15H,4-6,13H2,1-3H3