4-azanyl-1-(3-fluoranyl-1-adamantyl)butane-2-sulfonic acid

Systemtic Name: 4-azanyl-1-(3-fluoranyl-1-adamantyl)butane-2-sulfonic acid Openeye Name: 4-amino-1-(3-fluoro-1-adamantyl)butane-2-sulfonic acid CAS Name: 4-amino-1-(3-fluoro-1-adamantyl)-2-butanesulfonic acid IUPAC Name: 4-amino-1-(3-fluoro-1-adamantyl)butane-2-sulfonic acid Traditional Name: 4-amino-1-(3-fluoro-1-adamantyl)butane-2-sulfonic acid Formula: C14H24FNO3S MolecularWeight: 305.408663

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)F)CC(CCN)S(=O)(=O)O

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)F)CC(CCN)S(=O)(=O)O

InChI

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