ethyl 4-[(3-chloranyl-2-methyl-2-methylsulfanyl-propanoyl)amino]benzoate

Systemtic Name: ethyl 4-[(3-chloranyl-2-methyl-2-methylsulfanyl-propanoyl)amino]benzoate Openeye Name: ethyl 4-[(3-chloro-2-methyl-2-methylsulfanyl-propanoyl)amino]benzoate CAS Name: 4-[[3-chloro-2-methyl-2-(methylthio)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-chloro-2-methyl-2-methylsulfanylpropanoyl)amino]benzoate Traditional Name: 4-[[3-chloro-2-methyl-2-(methylthio)propanoyl]amino]benzoic acid ethyl ester Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)(CCl)SC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)(CCl)SC

InChI

InChI=1S/C14H18ClNO3S/c1-4-19-12(17)10-5-7-11(8-6-10)16-13(18)14(2,9-15)20-3/h5-8H,4,9H2,1-3H3,(H,16,18)