1-(undecan-6-ylamino)propan-2-yl hydrogen sulfate

Systemtic Name: 1-(undecan-6-ylamino)propan-2-yl hydrogen sulfate Openeye Name: [1-methyl-2-(1-pentylhexylamino)ethyl] hydrogen sulfate CAS Name: sulfuric acid 1-(undecan-6-ylamino)propan-2-yl ester IUPAC Name: 1-(undecan-6-ylamino)propan-2-yl hydrogen sulfate Traditional Name: sulfuric acid [2-(1-amylhexylamino)-1-methyl-ethyl] ester Formula: C14H31NO4S MolecularWeight: 309.46524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCCC)NCC(C)OS(=O)(=O)O

Isomeric SMILES

CCCCCC(CCCCC)NCC(C)OS(=O)(=O)O

InChI

InChI=1S/C14H31NO4S/c1-4-6-8-10-14(11-9-7-5-2)15-12-13(3)19-20(16,17)18/h13-15H,4-12H2,1-3H3,(H,16,17,18)