[1-(diphenylmethyl)azetidin-3-yl] hexane-1-sulfonate

Systemtic Name: [1-(diphenylmethyl)azetidin-3-yl] hexane-1-sulfonate Openeye Name: (1-benzhydrylazetidin-3-yl) hexane-1-sulfonate CAS Name: 1-hexanesulfonic acid IUPAC Name: (1-benzhydrylazetidin-3-yl) hexane-1-sulfonate Traditional Name: hexane-1-sulfonic acid (1-benzhydrylazetidin-3-yl) ester Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)OC1CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCS(=O)(=O)OC1CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29NO3S/c1-2-3-4-11-16-27(24,25)26-21-17-23(18-21)22(19-12-7-5-8-13-19)20-14-9-6-10-15-20/h5-10,12-15,21-22H,2-4,11,16-18H2,1H3