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

Systemtic Name: [3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]methyl 2-oxidanyl-2-phenyl-2-thiophen-2-yl-ethanoate Openeye Name: (3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-hydroxy-2-phenyl-2-(2-thienyl)acetate CAS Name: 2-hydroxy-2-phenyl-2-thiophen-2-ylacetic acid [3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]methyl ester IUPAC Name: (3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate Traditional Name: 2-hydroxy-2-phenyl-2-(2-thienyl)acetic acid (3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl)methyl ester Formula: C25H25NO3S MolecularWeight: 419.5359

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C2COC(=O)C(C3=CC=CC=C3)(C4=CC=CS4)O)CN1CC5=CC=CC=C5

Isomeric SMILES

C1C2C(C2COC(=O)C(C3=CC=CC=C3)(C4=CC=CS4)O)CN1CC5=CC=CC=C5

InChI

InChI=1S/C25H25NO3S/c27-24(25(28,23-12-7-13-30-23)19-10-5-2-6-11-19)29-17-22-20-15-26(16-21(20)22)14-18-8-3-1-4-9-18/h1-13,20-22,28H,14-17H2