tert-butyl 5-(1,3-dioxolan-2-yl)-3-oxidanyl-3-[1-(phenylsulfonyl)pyrrol-3-yl]pentanoate

Systemtic Name: tert-butyl 5-(1,3-dioxolan-2-yl)-3-oxidanyl-3-[1-(phenylsulfonyl)pyrrol-3-yl]pentanoate Openeye Name: tert-butyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-5-(1,3-dioxolan-2-yl)-3-hydroxy-pentanoate CAS Name: 3-[1-(benzenesulfonyl)-3-pyrrolyl]-5-(1,3-dioxolan-2-yl)-3-hydroxypentanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-(benzenesulfonyl)pyrrol-3-yl]-5-(1,3-dioxolan-2-yl)-3-hydroxypentanoate Traditional Name: 3-(1-besylpyrrol-3-yl)-5-(1,3-dioxolan-2-yl)-3-hydroxy-valeric acid tert-butyl ester Formula: C22H29NO7S MolecularWeight: 451.53316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCC1OCCO1)(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCC1OCCO1)(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H29NO7S/c1-21(2,3)30-19(24)15-22(25,11-9-20-28-13-14-29-20)17-10-12-23(16-17)31(26,27)18-7-5-4-6-8-18/h4-8,10,12,16,20,25H,9,11,13-15H2,1-3H3