ethyl (1R,2R)-3-oxidanylidene-1-thiophen-2-yl-2,4-dihydro-1H-azulene-2-carboxylate

Systemtic Name: ethyl (1R,2R)-3-oxidanylidene-1-thiophen-2-yl-2,4-dihydro-1H-azulene-2-carboxylate Openeye Name: ethyl (1R,2R)-3-oxo-1-(2-thienyl)-2,4-dihydro-1H-azulene-2-carboxylate CAS Name: (1R,2R)-3-oxo-1-thiophen-2-yl-2,4-dihydro-1H-azulene-2-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R)-3-oxo-1-thiophen-2-yl-2,4-dihydro-1H-azulene-2-carboxylate Traditional Name: (1R,2R)-3-keto-1-(2-thienyl)-2,4-dihydro-1H-azulene-2-carboxylic acid ethyl ester Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(C1=O)CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](C2=C(C1=O)CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C17H16O3S/c1-2-20-17(19)15-14(13-9-6-10-21-13)11-7-4-3-5-8-12(11)16(15)18/h3-7,9-10,14-15H,2,8H2,1H3/t14-,15-/m1/s1