3-azanyl-4-(3-fluoranyl-1-adamantyl)butane-1-sulfonic acid

Systemtic Name: 3-azanyl-4-(3-fluoranyl-1-adamantyl)butane-1-sulfonic acid Openeye Name: 3-amino-4-(3-fluoro-1-adamantyl)butane-1-sulfonic acid CAS Name: 3-amino-4-(3-fluoro-1-adamantyl)-1-butanesulfonic acid IUPAC Name: 3-amino-4-(3-fluoro-1-adamantyl)butane-1-sulfonic acid Traditional Name: 3-amino-4-(3-fluoro-1-adamantyl)butane-1-sulfonic acid Formula: C14H24FNO3S MolecularWeight: 305.408663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)F)CC(CCS(=O)(=O)O)N

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)F)CC(CCS(=O)(=O)O)N

InChI

InChI=1S/C14H24FNO3S/c15-14-6-10-3-11(7-14)5-13(4-10,9-14)8-12(16)1-2-20(17,18)19/h10-12H,1-9,16H2,(H,17,18,19)