ethyl 2-[(1S)-3-oxidanylidene-2-(phenylsulfonyl)-1,2-dihydropentalen-1-yl]ethanoate

Systemtic Name: ethyl 2-[(1S)-3-oxidanylidene-2-(phenylsulfonyl)-1,2-dihydropentalen-1-yl]ethanoate Openeye Name: ethyl 2-[(1S)-2-(benzenesulfonyl)-3-oxo-1,2-dihydropentalen-1-yl]acetate CAS Name: 2-[(1S)-2-(benzenesulfonyl)-3-oxo-1,2-dihydropentalen-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1S)-2-(benzenesulfonyl)-3-oxo-1,2-dihydropentalen-1-yl]acetate Traditional Name: 2-[(1S)-2-besyl-3-keto-1,2-dihydropentalen-1-yl]acetic acid ethyl ester Formula: C18H17O5S MolecularWeight: 345.38958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(C(=O)[C]2[C]1[CH][CH][CH]2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[C@@H]1C(C(=O)[C]2[C]1[CH][CH][CH]2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17O5S/c1-2-23-16(19)11-15-13-9-6-10-14(13)17(20)18(15)24(21,22)12-7-4-3-5-8-12/h3-10,15,18H,2,11H2,1H3/t15-,18?/m0/s1