1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)butan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)butan-1-one Openeye Name: 1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)butan-1-one CAS Name: 1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)butan-1-one Traditional Name: 1-(4-bromophenyl)-4-(2,4-dimethylphenoxy)butan-1-one Formula: C18H19BrO2 MolecularWeight: 347.24626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrO2/c1-13-5-10-18(14(2)12-13)21-11-3-4-17(20)15-6-8-16(19)9-7-15/h5-10,12H,3-4,11H2,1-2H3