tert-butyl 5-[4-(3-azanylpropoxy)phenyl]sulfonyloxane-3-carboxylate

Systemtic Name: tert-butyl 5-[4-(3-azanylpropoxy)phenyl]sulfonyloxane-3-carboxylate Openeye Name: tert-butyl 5-[4-(3-aminopropoxy)phenyl]sulfonyltetrahydropyran-3-carboxylate CAS Name: 5-[4-(3-aminopropoxy)phenyl]sulfonyl-3-oxanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[4-(3-aminopropoxy)phenyl]sulfonyloxane-3-carboxylate Traditional Name: 5-[4-(3-aminopropoxy)phenyl]sulfonyltetrahydropyran-3-carboxylic acid tert-butyl ester Formula: C19H29NO6S MolecularWeight: 399.50166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC(COC1)S(=O)(=O)C2=CC=C(C=C2)OCCCN

Isomeric SMILES

CC(C)(C)OC(=O)C1CC(COC1)S(=O)(=O)C2=CC=C(C=C2)OCCCN

InChI

InChI=1S/C19H29NO6S/c1-19(2,3)26-18(21)14-11-17(13-24-12-14)27(22,23)16-7-5-15(6-8-16)25-10-4-9-20/h5-8,14,17H,4,9-13,20H2,1-3H3