(4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: (4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: (4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid (4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl ester IUPAC Name: (4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-cyclohexyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid (4-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C2COC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O)CN1

Isomeric SMILES

CC1C2C(C2COC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O)CN1

InChI

InChI=1S/C21H29NO3/c1-14-19-17(12-22-14)18(19)13-25-20(23)21(24,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2,4-5,8-9,14,16-19,22,24H,3,6-7,10-13H2,1H3