(5-methyl-2-propan-2-yl-phenyl) 3-bromanyl-4-methoxy-benzoate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 3-bromanyl-4-methoxy-benzoate Openeye Name: (2-isopropyl-5-methyl-phenyl) 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C18H19BrO3 MolecularWeight: 363.24566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C18H19BrO3/c1-11(2)14-7-5-12(3)9-17(14)22-18(20)13-6-8-16(21-4)15(19)10-13/h5-11H,1-4H3