methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl 3-(4-hydroxyphenyl)-2-[(4-sec-butylphenyl)sulfonylamino]propanoate CAS Name: 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-butan-2-ylphenyl)sulfonylamino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[(4-sec-butylphenyl)sulfonylamino]propionic acid methyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC

InChI

InChI=1S/C20H25NO5S/c1-4-14(2)16-7-11-18(12-8-16)27(24,25)21-19(20(23)26-3)13-15-5-9-17(22)10-6-15/h5-12,14,19,21-22H,4,13H2,1-3H3