1-[(2-hexyl-2,3-dihydro-1H-indol-1-ium-1-yl)methyl]pyrrolidin-2-one chloride

Systemtic Name: 1-[(2-hexyl-2,3-dihydro-1H-indol-1-ium-1-yl)methyl]pyrrolidin-2-one chloride Openeye Name: 1-[(2-hexylindolin-1-ium-1-yl)methyl]pyrrolidin-2-one chloride CAS Name: 1-[(2-hexyl-2,3-dihydro-1H-indol-1-ium-1-yl)methyl]-2-pyrrolidinone chloride IUPAC Name: 1-[(2-hexyl-2,3-dihydro-1H-indol-1-ium-1-yl)methyl]pyrrolidin-2-one chloride Traditional Name: 1-[(2-hexylindolin-1-ium-1-yl)methyl]-2-pyrrolidone chloride Formula: C19H29ClN2O MolecularWeight: 336.89936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC2=CC=CC=C2[NH+]1CN3CCCC3=O.[Cl-]

Isomeric SMILES

CCCCCCC1CC2=CC=CC=C2[NH+]1CN3CCCC3=O.[Cl-]

InChI

InChI=1S/C19H28N2O.ClH/c1-2-3-4-5-10-17-14-16-9-6-7-11-18(16)21(17)15-20-13-8-12-19(20)22;/h6-7,9,11,17H,2-5,8,10,12-15H2,1H3;1H