[4-tert-butyl-2-(piperidin-1-ylmethyl)phenyl] hydrogen sulfate

Systemtic Name: [4-tert-butyl-2-(piperidin-1-ylmethyl)phenyl] hydrogen sulfate Openeye Name: [4-tert-butyl-2-(1-piperidylmethyl)phenyl] hydrogen sulfate CAS Name: sulfuric acid [4-tert-butyl-2-(1-piperidinylmethyl)phenyl] ester IUPAC Name: [4-tert-butyl-2-(piperidin-1-ylmethyl)phenyl] hydrogen sulfate Traditional Name: sulfuric acid [4-tert-butyl-2-(piperidinomethyl)phenyl] ester Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OS(=O)(=O)O)CN2CCCCC2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OS(=O)(=O)O)CN2CCCCC2

InChI

InChI=1S/C16H25NO4S/c1-16(2,3)14-7-8-15(21-22(18,19)20)13(11-14)12-17-9-5-4-6-10-17/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,18,19,20)