2-(3-methoxycarbonylindolizin-1-yl)ethyl-dimethyl-(phenylmethyl)azanium chloride

Systemtic Name: 2-(3-methoxycarbonylindolizin-1-yl)ethyl-dimethyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-[2-(3-methoxycarbonylindolizin-1-yl)ethyl]-dimethyl-ammonium chloride CAS Name: 2-(3-methoxycarbonyl-1-indolizinyl)ethyl-dimethyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-[2-(3-methoxycarbonylindolizin-1-yl)ethyl]-dimethylazanium chloride Traditional Name: benzyl-[2-(3-carbomethoxyindolizin-1-yl)ethyl]-dimethyl-ammonium chloride Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=C2C=CC=CN2C(=C1)C(=O)OC)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[N+](C)(CCC1=C2C=CC=CN2C(=C1)C(=O)OC)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H25N2O2.ClH/c1-23(2,16-17-9-5-4-6-10-17)14-12-18-15-20(21(24)25-3)22-13-8-7-11-19(18)22;/h4-11,13,15H,12,14,16H2,1-3H3;1H/q+1;/p-1