3-[(3,3,5-trimethylcyclohexyl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[(3,3,5-trimethylcyclohexyl)amino]propane-1-sulfonic acid Openeye Name: 3-[(3,3,5-trimethylcyclohexyl)amino]propane-1-sulfonic acid CAS Name: 3-[(3,3,5-trimethylcyclohexyl)amino]-1-propanesulfonic acid IUPAC Name: 3-[(3,3,5-trimethylcyclohexyl)amino]propane-1-sulfonic acid Traditional Name: 3-[(3,3,5-trimethylcyclohexyl)amino]propane-1-sulfonic acid Formula: C12H25NO3S MolecularWeight: 263.3968

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NCCCS(=O)(=O)O

Isomeric SMILES

CC1CC(CC(C1)(C)C)NCCCS(=O)(=O)O

InChI

InChI=1S/C12H25NO3S/c1-10-7-11(9-12(2,3)8-10)13-5-4-6-17(14,15)16/h10-11,13H,4-9H2,1-3H3,(H,14,15,16)