3-[[4-(4-bromanylphenoxy)phenyl]amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[[4-(4-bromanylphenoxy)phenyl]amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[4-(4-bromophenoxy)anilino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[4-(4-bromophenoxy)anilino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[4-(4-bromophenoxy)anilino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[4-(4-bromophenoxy)anilino]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C20H20BrNO2 MolecularWeight: 386.2823

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrNO2/c1-20(2)12-16(11-17(23)13-20)22-15-5-9-19(10-6-15)24-18-7-3-14(21)4-8-18/h3-11,22H,12-13H2,1-2H3