tert-butyl 3-(4-hydroxyphenyl)-2-[(1-pyridin-3-ylsulfonylpyrrolidin-2-yl)carbonylamino]propanoate

Systemtic Name: tert-butyl 3-(4-hydroxyphenyl)-2-[(1-pyridin-3-ylsulfonylpyrrolidin-2-yl)carbonylamino]propanoate Openeye Name: tert-butyl 3-(4-hydroxyphenyl)-2-[[1-(3-pyridylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[oxo-[1-(3-pyridinylsulfonyl)-2-pyrrolidinyl]methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-hydroxyphenyl)-2-[(1-pyridin-3-ylsulfonylpyrrolidine-2-carbonyl)amino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[[1-(3-pyridylsulfonyl)prolyl]amino]propionic acid tert-butyl ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2CCCN2S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2CCCN2S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H29N3O6S/c1-23(2,3)32-22(29)19(14-16-8-10-17(27)11-9-16)25-21(28)20-7-5-13-26(20)33(30,31)18-6-4-12-24-15-18/h4,6,8-12,15,19-20,27H,5,7,13-14H2,1-3H3,(H,25,28)