7-bromanyl-1-(3,4-dimethoxyphenyl)-2-phenyl-heptan-1-one

Systemtic Name: 7-bromanyl-1-(3,4-dimethoxyphenyl)-2-phenyl-heptan-1-one Openeye Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-phenyl-heptan-1-one CAS Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-phenyl-1-heptanone IUPAC Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-phenylheptan-1-one Traditional Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-phenyl-heptan-1-one Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(CCCCCBr)C2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C(CCCCCBr)C2=CC=CC=C2)OC

InChI

InChI=1S/C21H25BrO3/c1-24-19-13-12-17(15-20(19)25-2)21(23)18(11-7-4-8-14-22)16-9-5-3-6-10-16/h3,5-6,9-10,12-13,15,18H,4,7-8,11,14H2,1-2H3