azanyl 2-(5-cyano-2-oxidanyl-phenyl)sulfonyl-4-(4-propan-2-ylphenyl)butanoate

Systemtic Name: azanyl 2-(5-cyano-2-oxidanyl-phenyl)sulfonyl-4-(4-propan-2-ylphenyl)butanoate Openeye Name: amino 2-(5-cyano-2-hydroxy-phenyl)sulfonyl-4-(4-isopropylphenyl)butanoate CAS Name: 2-(5-cyano-2-hydroxyphenyl)sulfonyl-4-(4-propan-2-ylphenyl)butanoic acid amino ester IUPAC Name: amino 2-(5-cyano-2-hydroxyphenyl)sulfonyl-4-(4-propan-2-ylphenyl)butanoate Traditional Name: 2-(5-cyano-2-hydroxy-phenyl)sulfonyl-4-p-cumenyl-butyric acid amino ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCC(C(=O)ON)S(=O)(=O)C2=C(C=CC(=C2)C#N)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCC(C(=O)ON)S(=O)(=O)C2=C(C=CC(=C2)C#N)O

InChI

InChI=1S/C20H22N2O5S/c1-13(2)16-7-3-14(4-8-16)6-10-18(20(24)27-22)28(25,26)19-11-15(12-21)5-9-17(19)23/h3-5,7-9,11,13,18,23H,6,10,22H2,1-2H3