methyl (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxy-oct-3-ynoate

Systemtic Name: methyl (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxy-oct-3-ynoate Openeye Name: methyl (2R)-2-benzyloxy-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]oct-3-ynoate CAS Name: (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxy-3-octynoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-phenylmethoxyoct-3-ynoate Traditional Name: (2R)-2-benzoxy-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]oct-3-ynoic acid methyl ester Formula: C21H28O5 MolecularWeight: 360.44402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C1COC(O1)(C)C)(C(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC#C[C@@]([C@@H]1COC(O1)(C)C)(C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28O5/c1-5-6-7-11-14-21(19(22)23-4,18-16-24-20(2,3)26-18)25-15-17-12-9-8-10-13-17/h8-10,12-13,18H,5-7,15-16H2,1-4H3/t18-,21+/m0/s1