ethyl (4S)-4-acetyloxy-4-[(2R,3S)-2-methyl-3-phenyl-oxiran-2-yl]pent-2-ynoate

Systemtic Name: ethyl (4S)-4-acetyloxy-4-[(2R,3S)-2-methyl-3-phenyl-oxiran-2-yl]pent-2-ynoate Openeye Name: ethyl (4S)-4-acetoxy-4-[(2R,3S)-2-methyl-3-phenyl-oxiran-2-yl]pent-2-ynoate CAS Name: (4S)-4-acetyloxy-4-[(2R,3S)-2-methyl-3-phenyl-2-oxiranyl]-2-pentynoic acid ethyl ester IUPAC Name: ethyl (4S)-4-acetyloxy-4-[(2R,3S)-2-methyl-3-phenyloxiran-2-yl]pent-2-ynoate Traditional Name: (4S)-4-acetoxy-4-[(2R,3S)-2-methyl-3-phenyl-oxiran-2-yl]pent-2-ynoic acid ethyl ester Formula: C18H20O5 MolecularWeight: 316.3484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC(C)(C1(C(O1)C2=CC=CC=C2)C)OC(=O)C

Isomeric SMILES

CCOC(=O)C#C[C@@](C)([C@]1([C@@H](O1)C2=CC=CC=C2)C)OC(=O)C

InChI

InChI=1S/C18H20O5/c1-5-21-15(20)11-12-17(3,22-13(2)19)18(4)16(23-18)14-9-7-6-8-10-14/h6-10,16H,5H2,1-4H3/t16-,17-,18+/m0/s1