4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: 4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid 4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl ester IUPAC Name: 4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid 4-[(1R,5S)-4-methyl-3-azabicyclo[3.1.0]hexan-3-yl]but-2-ynyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC2CN1CC#CCOC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CC1[C@H]2C[C@H]2CN1CC#CCOC(=O)C(C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C24H31NO3/c1-18-22-16-19(22)17-25(18)14-8-9-15-28-23(26)24(27,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2,4-5,10-11,18-19,21-22,27H,3,6-7,12-17H2,1H3/t18?,19-,22+,24?/m0/s1