5-[2-oxidanyl-5-[(7-oxidanyl-7-oxidanylidene-hept-2-ynyl)-sulfinato-amino]pentoxy]-1,3-benzodioxole

Systemtic Name: 5-[2-oxidanyl-5-[(7-oxidanyl-7-oxidanylidene-hept-2-ynyl)-sulfinato-amino]pentoxy]-1,3-benzodioxole Openeye Name: 5-[2-hydroxy-5-[(7-hydroxy-7-oxo-hept-2-ynyl)-sulfinato-amino]pentoxy]-1,3-benzodioxole CAS Name: 5-[2-hydroxy-5-[(7-hydroxy-7-oxohept-2-ynyl)-sulfinatoamino]pentoxy]-1,3-benzodioxole IUPAC Name: 5-[2-hydroxy-5-[(7-hydroxy-7-oxohept-2-ynyl)-sulfinatoamino]pentoxy]-1,3-benzodioxole Traditional Name: 5-[2-hydroxy-5-[(7-hydroxy-7-keto-hept-2-ynyl)-sulfinato-amino]pentoxy]-1,3-benzodioxole Formula: C19H24NO8S- MolecularWeight: 426.46076

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC(CCCN(CC#CCCCC(=O)O)S(=O)[O-])O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC(CCCN(CC#CCCCC(=O)O)S(=O)[O-])O

InChI

InChI=1S/C19H25NO8S/c21-15(13-26-16-8-9-17-18(12-16)28-14-27-17)6-5-11-20(29(24)25)10-4-2-1-3-7-19(22)23/h8-9,12,15,21H,1,3,5-7,10-11,13-14H2,(H,22,23)(H,24,25)/p-1