[1-(3-azabicyclo[3.1.0]hexan-6-ylamino)-1-oxidanylidene-propan-2-yl] 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [1-(3-azabicyclo[3.1.0]hexan-6-ylamino)-1-oxidanylidene-propan-2-yl] 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [2-(3-azabicyclo[3.1.0]hexan-6-ylamino)-1-methyl-2-oxo-ethyl] 2-cyclohexyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid [1-(3-azabicyclo[3.1.0]hexan-6-ylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-azabicyclo[3.1.0]hexan-6-ylamino)-1-oxopropan-2-yl] 2-cyclohexyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid [2-(3-azabicyclo[3.1.0]hexan-6-ylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C2C1CNC2)OC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CC(C(=O)NC1C2C1CNC2)OC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C22H30N2O4/c1-14(20(25)24-19-17-12-23-13-18(17)19)28-21(26)22(27,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2,4-5,8-9,14,16-19,23,27H,3,6-7,10-13H2,1H3,(H,24,25)