O-propan-2-yl N-[4-chloranyl-3-(2-oxidanylidenepropoxy)phenyl]carbamothioate

Systemtic Name: O-propan-2-yl N-[4-chloranyl-3-(2-oxidanylidenepropoxy)phenyl]carbamothioate Openeye Name: O-isopropyl N-(3-acetonyloxy-4-chloro-phenyl)carbamothioate CAS Name: N-[4-chloro-3-(2-oxopropoxy)phenyl]carbamothioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl N-[4-chloro-3-(2-oxopropoxy)phenyl]carbamothioate Traditional Name: N-(3-acetonyloxy-4-chloro-phenyl)thiocarbamic acid O-isopropyl ester Formula: C13H16ClNO3S MolecularWeight: 301.78904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)OCC(=O)C

Isomeric SMILES

CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)OCC(=O)C

InChI

InChI=1S/C13H16ClNO3S/c1-8(2)18-13(19)15-10-4-5-11(14)12(6-10)17-7-9(3)16/h4-6,8H,7H2,1-3H3,(H,15,19)