cyclohexyl 4-phenyl-2-(phenylmethoxycarbonylamino)butane-1-sulfonate

Systemtic Name: cyclohexyl 4-phenyl-2-(phenylmethoxycarbonylamino)butane-1-sulfonate Openeye Name: cyclohexyl 2-(benzyloxycarbonylamino)-4-phenyl-butane-1-sulfonate CAS Name: 4-phenyl-2-(phenylmethoxycarbonylamino)-1-butanesulfonic acid IUPAC Name: cyclohexyl 4-phenyl-2-(phenylmethoxycarbonylamino)butane-1-sulfonate Traditional Name: 2-(benzyloxycarbonylamino)-4-phenyl-butane-1-sulfonic acid cyclohexyl ester Formula: C24H31NO5S MolecularWeight: 445.57164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OS(=O)(=O)CC(CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)OS(=O)(=O)CC(CCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H31NO5S/c26-24(29-18-21-12-6-2-7-13-21)25-22(17-16-20-10-4-1-5-11-20)19-31(27,28)30-23-14-8-3-9-15-23/h1-2,4-7,10-13,22-23H,3,8-9,14-19H2,(H,25,26)