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

Systemtic Name: propan-2-yl 2-chloranyl-5-[[6-(methoxymethyl)-2,3-dihydro-1,4-oxathiin-5-yl]carbonylamino]benzoate Openeye Name: isopropyl 2-chloro-5-[[6-(methoxymethyl)-2,3-dihydro-1,4-oxathiine-5-carbonyl]amino]benzoate CAS Name: 2-chloro-5-[[[6-(methoxymethyl)-2,3-dihydro-1,4-oxathiin-5-yl]-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-5-[[6-(methoxymethyl)-2,3-dihydro-1,4-oxathiine-5-carbonyl]amino]benzoate Traditional Name: 2-chloro-5-[[6-(methoxymethyl)-2,3-dihydro-1,4-oxathiin-5-carbonyl]amino]benzoic acid isopropyl ester Formula: C17H20ClNO5S MolecularWeight: 385.8624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(OCCS2)COC)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(OCCS2)COC)Cl

InChI

InChI=1S/C17H20ClNO5S/c1-10(2)24-17(21)12-8-11(4-5-13(12)18)19-16(20)15-14(9-22-3)23-6-7-25-15/h4-5,8,10H,6-7,9H2,1-3H3,(H,19,20)