ethyl 2-chloranyl-5-[(6-propyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[(6-propyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino]benzoate Openeye Name: ethyl 2-chloro-5-[(6-propyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino]benzoate CAS Name: 2-chloro-5-[[oxo-(6-propyl-2,3-dihydro-1,4-oxathiin-5-yl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-[(6-propyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino]benzoate Traditional Name: 2-chloro-5-[(6-propyl-2,3-dihydro-1,4-oxathiin-5-carbonyl)amino]benzoic acid ethyl ester Formula: C17H20ClNO4S MolecularWeight: 369.863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SCCO1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)OCC

Isomeric SMILES

CCCC1=C(SCCO1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)OCC

InChI

InChI=1S/C17H20ClNO4S/c1-3-5-14-15(24-9-8-23-14)16(20)19-11-6-7-13(18)12(10-11)17(21)22-4-2/h6-7,10H,3-5,8-9H2,1-2H3,(H,19,20)