[4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate

Systemtic Name: [4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate Openeye Name: [4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate CAS Name: [4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate IUPAC Name: [4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate Traditional Name: [4-[(E)-2-(4-bromophenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]but-1-enyl]phenyl] phosphate Formula: C26H27BrNO5P-2 MolecularWeight: 544.374041

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OCCN(C)C)C2=CC=C(C=C2)OP(=O)([O-])[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

CC/C(=C(/C1=CC=C(C=C1)OCCN(C)C)\C2=CC=C(C=C2)OP(=O)([O-])[O-])/C3=CC=C(C=C3)Br

InChI

InChI=1S/C26H29BrNO5P/c1-4-25(19-5-11-22(27)12-6-19)26(21-9-15-24(16-10-21)33-34(29,30)31)20-7-13-23(14-8-20)32-18-17-28(2)3/h5-16H,4,17-18H2,1-3H3,(H2,29,30,31)/p-2/b26-25+