1-(phenanthren-9-ylmethyl)pyrrolidin-1-ium-2-carboxylic acid chloride

Systemtic Name: 1-(phenanthren-9-ylmethyl)pyrrolidin-1-ium-2-carboxylic acid chloride Openeye Name: 1-(9-phenanthrylmethyl)pyrrolidin-1-ium-2-carboxylic acid chloride CAS Name: 1-(9-phenanthrenylmethyl)-2-pyrrolidin-1-iumcarboxylic acid chloride IUPAC Name: 1-(phenanthren-9-ylmethyl)pyrrolidin-1-ium-2-carboxylic acid chloride Traditional Name: 1-(9-phenanthrylmethyl)pyrrolidin-1-ium-2-carboxylic acid chloride Formula: C20H20ClNO2 MolecularWeight: 341.8313

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)O.[Cl-]

Isomeric SMILES

C1CC([NH+](C1)CC2=CC3=CC=CC=C3C4=CC=CC=C42)C(=O)O.[Cl-]

InChI

InChI=1S/C20H19NO2.ClH/c22-20(23)19-10-5-11-21(19)13-15-12-14-6-1-2-7-16(14)18-9-4-3-8-17(15)18;/h1-4,6-9,12,19H,5,10-11,13H2,(H,22,23);1H