5-(4-chlorophenyl)carbonyl-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride

Systemtic Name: 5-(4-chlorophenyl)carbonyl-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride Openeye Name: 5-(4-chlorobenzoyl)-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride IUPAC Name: 5-(4-chlorobenzoyl)-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride Traditional Name: 5-(4-chlorobenzoyl)-1,2,3,4-tetrahydropyrrolizin-4-ium-1-carboxylic acid chloride Formula: C15H13Cl2NO3 MolecularWeight: 326.17462

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2C(=CC=C2C(=O)C3=CC=C(C=C3)Cl)C1C(=O)O.[Cl-]

Isomeric SMILES

C1C[NH+]2C(=CC=C2C(=O)C3=CC=C(C=C3)Cl)C1C(=O)O.[Cl-]

InChI

InChI=1S/C15H12ClNO3.ClH/c16-10-3-1-9(2-4-10)14(18)13-6-5-12-11(15(19)20)7-8-17(12)13;/h1-6,11H,7-8H2,(H,19,20);1H