4-bromanyl-2-fluoranyl-N,N-bis(phenylmethyl)aniline; cyclopropanone

Systemtic Name: 4-bromanyl-2-fluoranyl-N,N-bis(phenylmethyl)aniline; cyclopropanone Openeye Name: cyclopropanone; N,N-dibenzyl-4-bromo-2-fluoro-aniline CAS Name: 4-bromo-2-fluoro-N,N-bis(phenylmethyl)aniline; cyclopropanone IUPAC Name: cyclopropanone; N,N-dibenzyl-4-bromo-2-fluoroaniline Traditional Name: cyclopropanone; dibenzyl-(4-bromo-2-fluoro-phenyl)amine Formula: C23H21BrFNO MolecularWeight: 426.321343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1=O.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CC1=O.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H17BrFN.C3H4O/c21-18-11-12-20(19(22)13-18)23(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17;4-3-1-2-3/h1-13H,14-15H2;1-2H2