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

Systemtic Name: (3R)-3-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: (3R)-3-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: (3R)-3-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: (3R)-3-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: (3R)-3-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-keto-ethyl]phthalide Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)CC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C[C@@H]3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C19H17NO3S/c21-18(12-16-13-6-1-2-7-14(13)19(22)23-16)20-10-5-11-24-17-9-4-3-8-15(17)20/h1-4,6-9,16H,5,10-12H2/t16-/m1/s1