methyl 4-[(5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(5-phenyl-2,3-dihydro-1,4-oxathiine-6-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-phenyl-2,3-dihydro-1,4-oxathiine-6-carbonyl)amino]benzoate Traditional Name: 4-[(5-phenyl-2,3-dihydro-1,4-oxathiin-6-carbonyl)amino]benzoic acid methyl ester Formula: C19H17NO4S MolecularWeight: 355.40758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(SCCO2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(SCCO2)C3=CC=CC=C3

InChI

InChI=1S/C19H17NO4S/c1-23-19(22)14-7-9-15(10-8-14)20-18(21)16-17(25-12-11-24-16)13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H,20,21)