(phenylmethyl) 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)but-2-enoate

Systemtic Name: (phenylmethyl) 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)but-2-enoate Openeye Name: benzyl 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)but-2-enoate CAS Name: 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)-2-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)but-2-enoate Traditional Name: 3-methyl-2-(2-methyl-3-thia-5-azabicyclo[2.2.0]hexan-5-yl)but-2-enoic acid benzyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CN(C2S1)C(=C(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1C2CN(C2S1)C(=C(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H21NO2S/c1-11(2)15(18-9-14-12(3)21-16(14)18)17(19)20-10-13-7-5-4-6-8-13/h4-8,12,14,16H,9-10H2,1-3H3