methyl 2-[[4-(3-chloranyl-2-cyano-phenoxy)phenyl]sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[4-(3-chloranyl-2-cyano-phenoxy)phenyl]sulfonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-(3-chloro-2-cyano-phenoxy)phenyl]sulfonylamino]-3-methyl-butanoate CAS Name: 2-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-(3-chloro-2-cyanophenoxy)phenyl]sulfonylamino]-3-methylbutanoate Traditional Name: 2-[[4-(3-chloro-2-cyano-phenoxy)phenyl]sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)C#N

Isomeric SMILES

CC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)C#N

InChI

InChI=1S/C19H19ClN2O5S/c1-12(2)18(19(23)26-3)22-28(24,25)14-9-7-13(8-10-14)27-17-6-4-5-16(20)15(17)11-21/h4-10,12,18,22H,1-3H3