tert-butyl (2R)-2-[[5-(4-hydroxyphenyl)thiophen-2-yl]sulfonylamino]-2-piperidin-4-yl-ethanoate

Systemtic Name: tert-butyl (2R)-2-[[5-(4-hydroxyphenyl)thiophen-2-yl]sulfonylamino]-2-piperidin-4-yl-ethanoate Openeye Name: tert-butyl (2R)-2-[[5-(4-hydroxyphenyl)-2-thienyl]sulfonylamino]-2-(4-piperidyl)acetate CAS Name: (2R)-2-[[5-(4-hydroxyphenyl)-2-thiophenyl]sulfonylamino]-2-(4-piperidinyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[[5-(4-hydroxyphenyl)thiophen-2-yl]sulfonylamino]-2-piperidin-4-ylacetate Traditional Name: (2R)-2-[[5-(4-hydroxyphenyl)-2-thienyl]sulfonylamino]-2-(4-piperidyl)acetic acid tert-butyl ester Formula: C21H28N2O5S2 MolecularWeight: 452.58742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1CCNCC1)NS(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](C1CCNCC1)NS(=O)(=O)C2=CC=C(S2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H28N2O5S2/c1-21(2,3)28-20(25)19(15-10-12-22-13-11-15)23-30(26,27)18-9-8-17(29-18)14-4-6-16(24)7-5-14/h4-9,15,19,22-24H,10-13H2,1-3H3/t19-/m1/s1