[1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-oxidanyl-propyl]cyclohexyl] sulfamate

Systemtic Name: [1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-oxidanyl-propyl]cyclohexyl] sulfamate Openeye Name: [1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-hydroxy-propyl]cyclohexyl] sulfamate CAS Name: sulfamic acid [1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-hydroxypropyl]cyclohexyl] ester IUPAC Name: [1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-hydroxypropyl]cyclohexyl] sulfamate Traditional Name: sulfamic acid [1-[1-(2-cyclopropylphenoxy)-3-(diethylamino)-2-hydroxy-propyl]cyclohexyl] ester Formula: C22H36N2O5S MolecularWeight: 440.59664

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C(C1(CCCCC1)OS(=O)(=O)N)OC2=CC=CC=C2C3CC3)O

Isomeric SMILES

CCN(CC)CC(C(C1(CCCCC1)OS(=O)(=O)N)OC2=CC=CC=C2C3CC3)O

InChI

InChI=1S/C22H36N2O5S/c1-3-24(4-2)16-19(25)21(22(29-30(23,26)27)14-8-5-9-15-22)28-20-11-7-6-10-18(20)17-12-13-17/h6-7,10-11,17,19,21,25H,3-5,8-9,12-16H2,1-2H3,(H2,23,26,27)