phenacyl 3-[(4-tert-butylphenyl)sulfonylamino]propanoate

Systemtic Name: phenacyl 3-[(4-tert-butylphenyl)sulfonylamino]propanoate Openeye Name: phenacyl 3-[(4-tert-butylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-[(4-tert-butylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]propionic acid phenacyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H25NO5S/c1-21(2,3)17-9-11-18(12-10-17)28(25,26)22-14-13-20(24)27-15-19(23)16-7-5-4-6-8-16/h4-12,22H,13-15H2,1-3H3