2-[(3R)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]ethanoate

Systemtic Name: 2-[(3R)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]ethanoate Openeye Name: 2-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]acetate CAS Name: 2-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]acetate IUPAC Name: 2-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]acetate Traditional Name: 2-[(3R)-4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]acetate Formula: C11H10NO3S- MolecularWeight: 236.267

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C2S1)CC(=O)[O-]

Isomeric SMILES

C1[C@@H](C(=O)NC2=CC=CC=C2S1)CC(=O)[O-]

InChI

InChI=1S/C11H11NO3S/c13-10(14)5-7-6-16-9-4-2-1-3-8(9)12-11(7)15/h1-4,7H,5-6H2,(H,12,15)(H,13,14)/p-1/t7-/m0/s1