[(1S)-2-oxidanylidenecyclohexyl] 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-furancarboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)furan-2-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H15NO4S/c20-12-6-2-3-7-13(12)23-18(21)15-10-9-14(22-15)17-19-11-5-1-4-8-16(11)24-17/h1,4-5,8-10,13H,2-3,6-7H2/t13-/m0/s1