3-[2-(4-methoxyphenyl)carbonylpyrrol-1-yl]propyl-dimethyl-azanium chloride

Systemtic Name: 3-[2-(4-methoxyphenyl)carbonylpyrrol-1-yl]propyl-dimethyl-azanium chloride Openeye Name: 3-[2-(4-methoxybenzoyl)pyrrol-1-yl]propyl-dimethyl-ammonium chloride CAS Name: 3-[2-[(4-methoxyphenyl)-oxomethyl]-1-pyrrolyl]propyl-dimethylammonium chloride IUPAC Name: 3-[2-(4-methoxybenzoyl)pyrrol-1-yl]propyl-dimethylazanium chloride Traditional Name: dimethyl-[3-(2-p-anisoylpyrrol-1-yl)propyl]ammonium chloride Formula: C17H23ClN2O2 MolecularWeight: 322.82972

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C=CC=C1C(=O)C2=CC=C(C=C2)OC.[Cl-]

Isomeric SMILES

C[NH+](C)CCCN1C=CC=C1C(=O)C2=CC=C(C=C2)OC.[Cl-]

InChI

InChI=1S/C17H22N2O2.ClH/c1-18(2)11-5-13-19-12-4-6-16(19)17(20)14-7-9-15(21-3)10-8-14;/h4,6-10,12H,5,11,13H2,1-3H3;1H