ethyl (1S,2S)-2-[2-(9H-thioxanthen-9-yl)ethanoyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-2-[2-(9H-thioxanthen-9-yl)ethanoyl]cyclopropane-1-carboxylate Openeye Name: ethyl (1S,2S)-2-[2-(9H-thioxanthen-9-yl)acetyl]cyclopropanecarboxylate CAS Name: (1S,2S)-2-[1-oxo-2-(9H-thioxanthen-9-yl)ethyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-2-[2-(9H-thioxanthen-9-yl)acetyl]cyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-[2-(9H-thioxanthen-9-yl)acetyl]cyclopropanecarboxylic acid ethyl ester Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1C(=O)CC2C3=CC=CC=C3SC4=CC=CC=C24

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@H]1C(=O)CC2C3=CC=CC=C3SC4=CC=CC=C24

InChI

InChI=1S/C21H20O3S/c1-2-24-21(23)17-11-16(17)18(22)12-15-13-7-3-5-9-19(13)25-20-10-6-4-8-14(15)20/h3-10,15-17H,2,11-12H2,1H3/t16-,17-/m0/s1