ethyl 2-(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)ethanoate

Systemtic Name: ethyl 2-(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)ethanoate Openeye Name: ethyl 2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetate CAS Name: 2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetate Traditional Name: 2-(4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl)acetic acid ethyl ester Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CSC2=CC=CC=C2NC1=O

Isomeric SMILES

CCOC(=O)CC1CSC2=CC=CC=C2NC1=O

InChI

InChI=1S/C13H15NO3S/c1-2-17-12(15)7-9-8-18-11-6-4-3-5-10(11)14-13(9)16/h3-6,9H,2,7-8H2,1H3,(H,14,16)