1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluoranyl-phenyl)cyclohexyl]amino]butan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluoranyl-phenyl)cyclohexyl]amino]butan-1-one Openeye Name: 1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluoro-phenyl)cyclohexyl]amino]butan-1-one CAS Name: 1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluorophenyl)cyclohexyl]amino]-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluorophenyl)cyclohexyl]amino]butan-1-one Traditional Name: 1-(4-bromophenyl)-4-[[4-ethoxy-4-(3-ethyl-5-fluoro-phenyl)cyclohexyl]amino]butan-1-one Formula: C26H33BrFNO2 MolecularWeight: 490.448123

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1)C2(CCC(CC2)NCCCC(=O)C3=CC=C(C=C3)Br)OCC)F

Isomeric SMILES

CCC1=CC(=CC(=C1)C2(CCC(CC2)NCCCC(=O)C3=CC=C(C=C3)Br)OCC)F

InChI

InChI=1S/C26H33BrFNO2/c1-3-19-16-21(18-23(28)17-19)26(31-4-2)13-11-24(12-14-26)29-15-5-6-25(30)20-7-9-22(27)10-8-20/h7-10,16-18,24,29H,3-6,11-15H2,1-2H3