1-[[3,5-bis(fluoranyl)phenyl]carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[[3,5-bis(fluoranyl)phenyl]carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(3,5-difluorobenzoyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(3,5-difluorophenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(3,5-difluorobenzoyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(3,5-difluorobenzoyl)amino]cycloheptanecarboxylic acid Formula: C15H17F2NO3 MolecularWeight: 297.297186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=CC(=C2)F)F

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=CC(=C2)F)F

InChI

InChI=1S/C15H17F2NO3/c16-11-7-10(8-12(17)9-11)13(19)18-15(14(20)21)5-3-1-2-4-6-15/h7-9H,1-6H2,(H,18,19)(H,20,21)