methylsulfanylmethyl 2-[2-[2-(tert-butylamino)-1-oxidanyl-ethyl]-1-benzofuran-7-yl]ethanoate

Systemtic Name: methylsulfanylmethyl 2-[2-[2-(tert-butylamino)-1-oxidanyl-ethyl]-1-benzofuran-7-yl]ethanoate Openeye Name: methylsulfanylmethyl 2-[2-[2-(tert-butylamino)-1-hydroxy-ethyl]benzofuran-7-yl]acetate CAS Name: 2-[2-[2-(tert-butylamino)-1-hydroxyethyl]-7-benzofuranyl]acetic acid (methylthio)methyl ester IUPAC Name: methylsulfanylmethyl 2-[2-[2-(tert-butylamino)-1-hydroxyethyl]-1-benzofuran-7-yl]acetate Traditional Name: 2-[2-[2-(tert-butylamino)-1-hydroxy-ethyl]benzofuran-7-yl]acetic acid (methylthio)methyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(C1=CC2=C(O1)C(=CC=C2)CC(=O)OCSC)O

Isomeric SMILES

CC(C)(C)NCC(C1=CC2=C(O1)C(=CC=C2)CC(=O)OCSC)O

InChI

InChI=1S/C18H25NO4S/c1-18(2,3)19-10-14(20)15-8-12-6-5-7-13(17(12)23-15)9-16(21)22-11-24-4/h5-8,14,19-20H,9-11H2,1-4H3