(1S)-1-[3,4-bis(fluoranyl)phenyl]-N-butyl-N-methyl-ethane-1,2-diamine

Systemtic Name: (1S)-1-[3,4-bis(fluoranyl)phenyl]-N-butyl-N-methyl-ethane-1,2-diamine Openeye Name: (1S)-N-butyl-1-(3,4-difluorophenyl)-N-methyl-ethane-1,2-diamine CAS Name: (1S)-N-butyl-1-(3,4-difluorophenyl)-N-methylethane-1,2-diamine IUPAC Name: (1S)-N-butyl-1-(3,4-difluorophenyl)-N-methylethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(3,4-difluorophenyl)ethyl]-butyl-methyl-amine Formula: C13H20F2N2 MolecularWeight: 242.308106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(CN)C1=CC(=C(C=C1)F)F

Isomeric SMILES

CCCCN(C)[C@H](CN)C1=CC(=C(C=C1)F)F

InChI

InChI=1S/C13H20F2N2/c1-3-4-7-17(2)13(9-16)10-5-6-11(14)12(15)8-10/h5-6,8,13H,3-4,7,9,16H2,1-2H3/t13-/m1/s1