2-(4-fluoranylphenoxy)ethyl 4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylate

Systemtic Name: 2-(4-fluoranylphenoxy)ethyl 4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylate Openeye Name: 2-(4-fluorophenoxy)ethyl 4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylate CAS Name: 4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylic acid 2-(4-fluorophenoxy)ethyl ester IUPAC Name: 2-(4-fluorophenoxy)ethyl 4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylate Traditional Name: 4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxylic acid 2-(4-fluorophenoxy)ethyl ester Formula: C18H16FNO4S MolecularWeight: 361.387343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)F)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)OCCOC3=CC=C(C=C3)F)NC1=O

InChI

InChI=1S/C18H16FNO4S/c19-13-2-4-14(5-3-13)23-8-9-24-18(22)12-1-6-16-15(11-12)20-17(21)7-10-25-16/h1-6,11H,7-10H2,(H,20,21)