1-[2-(3-fluorophenyl)ethanoylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-(3-fluorophenyl)ethanoylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[[2-(3-fluorophenyl)acetyl]amino]cycloheptanecarboxylic acid CAS Name: 1-[[2-(3-fluorophenyl)-1-oxoethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[[2-(3-fluorophenyl)acetyl]amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[[2-(3-fluorophenyl)acetyl]amino]cycloheptanecarboxylic acid Formula: C16H20FNO3 MolecularWeight: 293.333303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)CC2=CC(=CC=C2)F

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)CC2=CC(=CC=C2)F

InChI

InChI=1S/C16H20FNO3/c17-13-7-5-6-12(10-13)11-14(19)18-16(15(20)21)8-3-1-2-4-9-16/h5-7,10H,1-4,8-9,11H2,(H,18,19)(H,20,21)