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

Systemtic Name: 2,4-dimethylpentan-3-yl 2-chloranyl-5-[(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)carbonylamino]benzoate Openeye Name: (1-isopropyl-2-methyl-propyl) 2-chloro-5-[(6-methyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino]benzoate CAS Name: 2-chloro-5-[[(6-methyl-2,3-dihydro-1,4-oxathiin-5-yl)-oxomethyl]amino]benzoic acid 2,4-dimethylpentan-3-yl ester IUPAC Name: 2,4-dimethylpentan-3-yl 2-chloro-5-[(6-methyl-2,3-dihydro-1,4-oxathiine-5-carbonyl)amino]benzoate Traditional Name: 2-chloro-5-[(6-methyl-2,3-dihydro-1,4-oxathiin-5-carbonyl)amino]benzoic acid (1-isopropyl-2-methyl-propyl) ester Formula: C20H26ClNO4S MolecularWeight: 411.94274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCO1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC(C(C)C)C(C)C

Isomeric SMILES

CC1=C(SCCO1)C(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC(C(C)C)C(C)C

InChI

InChI=1S/C20H26ClNO4S/c1-11(2)17(12(3)4)26-20(24)15-10-14(6-7-16(15)21)22-19(23)18-13(5)25-8-9-27-18/h6-7,10-12,17H,8-9H2,1-5H3,(H,22,23)