Se-phenyl 3-[[2-bromanylprop-2-enyl(ethanoyl)amino]methyl]-1-methyl-indole-2-carboselenoate

Systemtic Name: Se-phenyl 3-[[2-bromanylprop-2-enyl(ethanoyl)amino]methyl]-1-methyl-indole-2-carboselenoate Openeye Name: Se-phenyl 3-[[acetyl(2-bromoallyl)amino]methyl]-1-methyl-indole-2-carboselenoate CAS Name: 3-[[acetyl(2-bromoprop-2-enyl)amino]methyl]-1-methyl-2-indolecarboselenoic acid Se-phenyl ester IUPAC Name: Se-phenyl 3-[[acetyl(2-bromoprop-2-enyl)amino]methyl]-1-methylindole-2-carboselenoate Traditional Name: 3-[[acetyl(2-bromoallyl)amino]methyl]-1-methyl-indole-2-carboselenoic acid Se-phenyl ester Formula: C22H21BrN2O2Se MolecularWeight: 504.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=C(N(C2=CC=CC=C21)C)C(=O)[Se]C3=CC=CC=C3)CC(=C)Br

Isomeric SMILES

CC(=O)N(CC1=C(N(C2=CC=CC=C21)C)C(=O)[Se]C3=CC=CC=C3)CC(=C)Br

InChI

InChI=1S/C22H21BrN2O2Se/c1-15(23)13-25(16(2)26)14-19-18-11-7-8-12-20(18)24(3)21(19)22(27)28-17-9-5-4-6-10-17/h4-12H,1,13-14H2,2-3H3