tert-butyl 2-(naphthalen-2-ylmethoxy)-5-[1-oxidanyl-1-(1,3-thiazol-2-yl)propyl]benzoate

Systemtic Name: tert-butyl 2-(naphthalen-2-ylmethoxy)-5-[1-oxidanyl-1-(1,3-thiazol-2-yl)propyl]benzoate Openeye Name: tert-butyl 5-(1-hydroxy-1-thiazol-2-yl-propyl)-2-(2-naphthylmethoxy)benzoate CAS Name: 5-[1-hydroxy-1-(2-thiazolyl)propyl]-2-(2-naphthalenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 5-[1-hydroxy-1-(1,3-thiazol-2-yl)propyl]-2-(naphthalen-2-ylmethoxy)benzoate Traditional Name: 5-(1-hydroxy-1-thiazol-2-yl-propyl)-2-(2-naphthylmethoxy)benzoic acid tert-butyl ester Formula: C28H29NO4S MolecularWeight: 475.59916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OCC2=CC3=CC=CC=C3C=C2)C(=O)OC(C)(C)C)(C4=NC=CS4)O

Isomeric SMILES

CCC(C1=CC(=C(C=C1)OCC2=CC3=CC=CC=C3C=C2)C(=O)OC(C)(C)C)(C4=NC=CS4)O

InChI

InChI=1S/C28H29NO4S/c1-5-28(31,26-29-14-15-34-26)22-12-13-24(23(17-22)25(30)33-27(2,3)4)32-18-19-10-11-20-8-6-7-9-21(20)16-19/h6-17,31H,5,18H2,1-4H3