2-(3-azanylpentan-3-yl)-1-[(5-chloranyl-2-fluoranyl-phenyl)methyl]cyclohexan-1-ol; ethanedioic acid

Systemtic Name: 2-(3-azanylpentan-3-yl)-1-[(5-chloranyl-2-fluoranyl-phenyl)methyl]cyclohexan-1-ol; ethanedioic acid Openeye Name: 2-(1-amino-1-ethyl-propyl)-1-[(5-chloro-2-fluoro-phenyl)methyl]cyclohexanol; oxalic acid CAS Name: 2-(3-aminopentan-3-yl)-1-[(5-chloro-2-fluorophenyl)methyl]-1-cyclohexanol; oxalic acid IUPAC Name: 2-(3-aminopentan-3-yl)-1-[(5-chloro-2-fluorophenyl)methyl]cyclohexan-1-ol; oxalic acid Traditional Name: 2-(1-amino-1-ethyl-propyl)-1-(5-chloro-2-fluoro-benzyl)cyclohexanol; oxalic acid Formula: C20H29ClFNO5 MolecularWeight: 417.899363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1CCCCC1(CC2=C(C=CC(=C2)Cl)F)O)N.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC)(C1CCCCC1(CC2=C(C=CC(=C2)Cl)F)O)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27ClFNO.C2H2O4/c1-3-17(21,4-2)16-7-5-6-10-18(16,22)12-13-11-14(19)8-9-15(13)20;3-1(4)2(5)6/h8-9,11,16,22H,3-7,10,12,21H2,1-2H3;(H,3,4)(H,5,6)