3-(1-adamantylmethylamino)propane-1-sulfonic acid

Systemtic Name: 3-(1-adamantylmethylamino)propane-1-sulfonic acid Openeye Name: 3-(1-adamantylmethylamino)propane-1-sulfonic acid CAS Name: 3-(1-adamantylmethylamino)-1-propanesulfonic acid IUPAC Name: 3-(1-adamantylmethylamino)propane-1-sulfonic acid Traditional Name: 3-(1-adamantylmethylamino)propane-1-sulfonic acid Formula: C14H25NO3S MolecularWeight: 287.4182

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNCCCS(=O)(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNCCCS(=O)(=O)O

InChI

InChI=1S/C14H25NO3S/c16-19(17,18)3-1-2-15-10-14-7-11-4-12(8-14)6-13(5-11)9-14/h11-13,15H,1-10H2,(H,16,17,18)