(2-bromanyl-4-methyl-phenyl) 4-heptoxybenzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 4-heptoxybenzoate Openeye Name: (2-bromo-4-methyl-phenyl) 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C21H25BrO3/c1-3-4-5-6-7-14-24-18-11-9-17(10-12-18)21(23)25-20-13-8-16(2)15-19(20)22/h8-13,15H,3-7,14H2,1-2H3