5-decoxy-1-oxidanidyl-1-(phenylmethyl)pyrrolidin-1-ium-2-one

Systemtic Name: 5-decoxy-1-oxidanidyl-1-(phenylmethyl)pyrrolidin-1-ium-2-one Openeye Name: 1-benzyl-5-decoxy-1-oxido-pyrrolidin-1-ium-2-one CAS Name: 5-decoxy-1-oxido-1-(phenylmethyl)-2-pyrrolidin-1-iumone IUPAC Name: 1-benzyl-5-decoxy-1-oxidopyrrolidin-1-ium-2-one Traditional Name: 1-benzyl-5-decoxy-1-oxido-pyrrolidin-1-ium-2-one Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1CCC(=O)[N+]1(CC2=CC=CC=C2)[O-]

Isomeric SMILES

CCCCCCCCCCOC1CCC(=O)[N+]1(CC2=CC=CC=C2)[O-]

InChI

InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-12-17-25-21-16-15-20(23)22(21,24)18-19-13-10-9-11-14-19/h9-11,13-14,21H,2-8,12,15-18H2,1H3